Calcium Bis[4-[[1-[[(4-Methoxyphenyl)Amino]Carbonyl]-2-Oxopropyl]Azo]-3-Nitrobenzenesulphonate]
[CAS# 73385-03-2]

Identification

• Name: Calcium Bis[4-[[1-[[(4-Methoxyphenyl)Amino]Carbonyl]-2-Oxopropyl]Azo]-3-Nitrobenzenesulphonate]
• Synonyms: Calcium 4-[1-[(4-Methoxyphenyl)Carbamoyl]-2-Oxo-Propyl]Azo-3-Nitro-Benzenesulfonate; Calcium 4-[1-[[(4-Methoxyphenyl)Amino]-Oxomethyl]-2-Oxopropyl]Azo-3-Nitrobenzenesulfonate; Calcium 4-[2-Keto-1-[(4-Methoxyphenyl)Carbamoyl]Propyl]Azo-3-Nitro-Benzenesulfonate
• Molecular Formula: C₃₄H₃₀CaN₈O₁₆S₂
• Molecular Weight: 910.86
• CAS Registry Number: 73385-03-2
• EINECS: 277-421-3
• SMILES: C1=C([N+]([O-])=O)C(=CC=C1[S]([O-])(=O)=O)N=NC(C(=O)NC2=CC=C(OC)C=C2)C(=O)C.C3=C([N+]([O-])=O)C(=CC=C3[S]([O-])(=O)=O)N=NC(C(=O)NC4=CC=C(OC)C=C4)C(=O)C.[Ca++]
• InChI: 1S/2C17H16N4O8S.Ca/c2*1-10(22)16(17(23)18-11-3-5-12(29-2)6-4-11)20-19-14-8-7-13(30(26,27)28)9-15(14)21(24)25;/h2*3-9,16H,1-2H3,(H,18,23)(H,26,27,28);/q;;+2/p-2
• InChIKey: LJZNJAZFGMKGKA-UHFFFAOYSA-L