ethyl 2-methyl-1-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-5-oxidanyl-benzo[g]indole-3-carboxylate

Systemtic Name: ethyl 2-methyl-1-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-5-oxidanyl-benzo[g]indole-3-carboxylate Openeye Name: ethyl 5-hydroxy-1-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-methyl-benzo[g]indole-3-carboxylate CAS Name: 5-hydroxy-1-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-methyl-3-benzo[g]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-1-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-methylbenzo[g]indole-3-carboxylate Traditional Name: 5-hydroxy-1-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-methyl-benz[g]indole-3-carboxylic acid ethyl ester Formula: C24H22N2O6 MolecularWeight: 434.44128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C3=CC=CC=C32)O)CC(C4=CC=C(C=C4)[N+](=O)[O-])O)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C3=CC=CC=C32)O)CC(C4=CC=C(C=C4)[N+](=O)[O-])O)C

InChI

InChI=1S/C24H22N2O6/c1-3-32-24(29)22-14(2)25(13-21(28)15-8-10-16(11-9-15)26(30)31)23-18-7-5-4-6-17(18)20(27)12-19(22)23/h4-12,21,27-28H,3,13H2,1-2H3