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

Systemtic Name: ethyl 1-butyl-2-methyl-5-(3-nitrophenyl)carbonyloxy-benzo[g]indole-3-carboxylate Openeye Name: ethyl 1-butyl-2-methyl-5-(3-nitrobenzoyl)oxy-benzo[g]indole-3-carboxylate CAS Name: 1-butyl-2-methyl-5-[(3-nitrophenyl)-oxomethoxy]-3-benzo[g]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-butyl-2-methyl-5-(3-nitrobenzoyl)oxybenzo[g]indole-3-carboxylate Traditional Name: 1-butyl-2-methyl-5-(3-nitrobenzoyl)oxy-benz[g]indole-3-carboxylic acid ethyl ester Formula: C27H26N2O6 MolecularWeight: 474.50514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=C1C3=CC=CC=C3C(=C2)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OCC)C

Isomeric SMILES

CCCCN1C(=C(C2=C1C3=CC=CC=C3C(=C2)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OCC)C

InChI

InChI=1S/C27H26N2O6/c1-4-6-14-28-17(3)24(27(31)34-5-2)22-16-23(20-12-7-8-13-21(20)25(22)28)35-26(30)18-10-9-11-19(15-18)29(32)33/h7-13,15-16H,4-6,14H2,1-3H3