Sodium 3-[(5E)-3-(5-Carboxypentyl)-5-{(2E)-2-[7-(Diethylamino)-4-(2-Methyl-2-Propanyl)-2H-Chromen-2-Ylidene]Ethylidene}-2,4,6-Trioxotetrahydro-1(2H)-Pyrimidinyl]-1-Propanesulfonate
[CAS# 482379-37-3]

Identification

• Name: Sodium 3-[(5E)-3-(5-Carboxypentyl)-5-{(2E)-2-[7-(Diethylamino)-4-(2-Methyl-2-Propanyl)-2H-Chromen-2-Ylidene]Ethylidene}-2,4,6-Trioxotetrahydro-1(2H)-Pyrimidinyl]-1-Propanesulfonate
• Synonyms: 1(2H)-Pyrimidinehexanoic acid, 5-[(2E)-2-[7-(diethylamino)-4-(1,1-dimethylethyl)-2H-1-benzopyran-2-ylidene]ethylidene]tetrahydro-2,4,6-trioxo-3-(3-sulfopropyl)-, sodium salt, (5E)- (1:1); 3-[(5E)-3-(5-Carboxypentyl)-5-{(2E)-2-[7-(diéthylamino)-4-(2-méthyl-2-propanyl)-2H-chromén-2-ylidène]éthylidène}-2,4,6-trioxotétrahydro-1(2H)-pyrimidinyl]-1-propanesulfonate de sodium
• Molecular Formula: C₃₂H₄₂N₃NaO₉S
• Molecular Weight: 667.75
• CAS Registry Number: 482379-37-3
• SMILES: CCN(CC)c1ccc2c(c1)O/C(=C/C=C/3\C(=O)N(C(=O)N(C3=O)CCCS(=O)(=O)[O-])CCCCCC(=O)O)/C=C2C(C)(C)C.[Na+]
• InChI: 1S/C32H43N3O9S.Na/c1-6-33(7-2)22-13-15-24-26(32(3,4)5)21-23(44-27(24)20-22)14-16-25-29(38)34(17-10-8-9-12-28(36)37)31(40)35(30(25)39)18-11-19-45(41,42)43;/h13-16,20-21H,6-12,17-19H2,1-5H3,(H,36,37)(H,41,42,43);/q;+1/p-1/b23-14+,25-16+
• InChIKey: HMAWMSKJKAVASI-ODYCTADWSA-M

Properties

• Refractive index: (Cal.)