N-(4-Azidobenzoyl)-N'-beta-Aminoethylvindesine
[CAS# 103974-27-2]

Identification

• Name: N-(4-Azidobenzoyl)-N'-beta-Aminoethylvindesine
• Synonyms: N-(4-Azidobenzoyl)-N'-(2-Aminoethyl)Vindesine; N-(4-Azidobenzoyl)-N'-Beta-Aminoethylvindesine; Nabv
• Molecular Formula: C₅₂H₆₃N₉O₈
• Molecular Weight: 942.13
• CAS Registry Number: 103974-27-2
• SMILES: [N+](=NC%10=CC=C(C(=O)[N]1C3=C(C2=CC=CC=C12)CCN9C[C@@H](C[C@@]3(C8=C(OC)C=C7N([C@@H]6C4([C@H]5N(CC4)CC=C[C@]5([C@@H](O)[C@]6(O)C(=O)NCCN)CC)C7=C8)C)C(OC)=O)C[C@](O)(C9)CC)C=C%10)=[N-]
• InChI: 1S/C52H63N9O8/c1-6-48(66)27-31-28-51(47(65)69-5,41-35(17-23-59(29-31)30-48)34-11-8-9-12-38(34)61(41)42(62)32-13-15-33(16-14-32)56-57-54)37-25-36-39(26-40(37)68-4)58(3)44-50(36)19-24-60-22-10-18-49(7-2,43(50)60)45(63)52(44,67)46(64)55-21-20-53/h8-16,18,25-26,31,43-45,63,66-67H,6-7,17,19-24,27-30,53H2,1-5H3,(H,55,64)/t31-,43+,44-,45-,48+,49-,50?,51+,52+/m1/s1
• InChIKey: JGCLDPQQVPZGTK-NRUYZIJJSA-N