ethyl 1-cyclohexyl-2-methyl-5-[2-nitro-4-(phenylcarbonyl)phenoxy]benzo[g]indole-3-carboxylate

Systemtic Name: ethyl 1-cyclohexyl-2-methyl-5-[2-nitro-4-(phenylcarbonyl)phenoxy]benzo[g]indole-3-carboxylate Openeye Name: ethyl 5-(4-benzoyl-2-nitro-phenoxy)-1-cyclohexyl-2-methyl-benzo[g]indole-3-carboxylate CAS Name: 5-(4-benzoyl-2-nitrophenoxy)-1-cyclohexyl-2-methyl-3-benzo[g]indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-benzoyl-2-nitrophenoxy)-1-cyclohexyl-2-methylbenzo[g]indole-3-carboxylate Traditional Name: 5-(4-benzoyl-2-nitro-phenoxy)-1-cyclohexyl-2-methyl-benz[g]indole-3-carboxylic acid ethyl ester Formula: C35H32N2O6 MolecularWeight: 576.63838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C3=CC=CC=C32)OC4=C(C=C(C=C4)C(=O)C5=CC=CC=C5)[N+](=O)[O-])C6CCCCC6)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C3=CC=CC=C32)OC4=C(C=C(C=C4)C(=O)C5=CC=CC=C5)[N+](=O)[O-])C6CCCCC6)C

InChI

InChI=1S/C35H32N2O6/c1-3-42-35(39)32-22(2)36(25-14-8-5-9-15-25)33-27-17-11-10-16-26(27)31(21-28(32)33)43-30-19-18-24(20-29(30)37(40)41)34(38)23-12-6-4-7-13-23/h4,6-7,10-13,16-21,25H,3,5,8-9,14-15H2,1-2H3