(5-ethyl-3-methyl-2-nitro-imidazol-4-yl)methyl-[[6-methoxy-7-prop-1-ynyl-3-(3,4,5-trimethoxyphenyl)carbonyl-indazol-1-yl]methyl]-dimethyl-azanium; 2-oxidanylpropanoate

Systemtic Name: (5-ethyl-3-methyl-2-nitro-imidazol-4-yl)methyl-[[6-methoxy-7-prop-1-ynyl-3-(3,4,5-trimethoxyphenyl)carbonyl-indazol-1-yl]methyl]-dimethyl-azanium; 2-oxidanylpropanoate Openeye Name: (5-ethyl-3-methyl-2-nitro-imidazol-4-yl)methyl-[[6-methoxy-7-prop-1-ynyl-3-(3,4,5-trimethoxybenzoyl)indazol-1-yl]methyl]-dimethyl-ammonium; 2-hydroxypropanoate CAS Name: (5-ethyl-3-methyl-2-nitro-4-imidazolyl)methyl-[[6-methoxy-3-[oxo-(3,4,5-trimethoxyphenyl)methyl]-7-prop-1-ynyl-1-indazolyl]methyl]-dimethylammonium; 2-hydroxypropanoate IUPAC Name: (5-ethyl-3-methyl-2-nitroimidazol-4-yl)methyl-[[6-methoxy-7-prop-1-ynyl-3-(3,4,5-trimethoxybenzoyl)indazol-1-yl]methyl]-dimethylazanium; 2-hydroxypropanoate Traditional Name: (5-ethyl-3-methyl-2-nitro-imidazol-4-yl)methyl-[[6-methoxy-7-prop-1-ynyl-3-(3,4,5-trimethoxybenzoyl)indazol-1-yl]methyl]-dimethyl-ammonium; lactate Formula: C34H42N6O10 MolecularWeight: 694.73148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=N1)[N+](=O)[O-])C)C[N+](C)(C)CN2C3=C(C=CC(=C3C#CC)OC)C(=N2)C(=O)C4=CC(=C(C(=C4)OC)OC)OC.CC(C(=O)[O-])O

Isomeric SMILES

CCC1=C(N(C(=N1)[N+](=O)[O-])C)C[N+](C)(C)CN2C3=C(C=CC(=C3C#CC)OC)C(=N2)C(=O)C4=CC(=C(C(=C4)OC)OC)OC.CC(C(=O)[O-])O

InChI

InChI=1S/C31H37N6O7.C3H6O3/c1-10-12-20-24(41-6)14-13-21-27(29(38)19-15-25(42-7)30(44-9)26(16-19)43-8)33-35(28(20)21)18-37(4,5)17-23-22(11-2)32-31(34(23)3)36(39)40;1-2(4)3(5)6/h13-16H,11,17-18H2,1-9H3;2,4H,1H3,(H,5,6)/q+1;/p-1