2-(4-chlorophenyl)-3-[1-(3,4-dimethoxyphenyl)-2-nitro-ethyl]-1H-indole

Systemtic Name: 2-(4-chlorophenyl)-3-[1-(3,4-dimethoxyphenyl)-2-nitro-ethyl]-1H-indole Openeye Name: 2-(4-chlorophenyl)-3-[1-(3,4-dimethoxyphenyl)-2-nitro-ethyl]-1H-indole CAS Name: 2-(4-chlorophenyl)-3-[1-(3,4-dimethoxyphenyl)-2-nitroethyl]-1H-indole IUPAC Name: 2-(4-chlorophenyl)-3-[1-(3,4-dimethoxyphenyl)-2-nitroethyl]-1H-indole Traditional Name: 2-(4-chlorophenyl)-3-[1-(3,4-dimethoxyphenyl)-2-nitro-ethyl]-1H-indole Formula: C24H21ClN2O4 MolecularWeight: 436.88754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C[N+](=O)[O-])C2=C(NC3=CC=CC=C32)C4=CC=C(C=C4)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C[N+](=O)[O-])C2=C(NC3=CC=CC=C32)C4=CC=C(C=C4)Cl)OC

InChI

InChI=1S/C24H21ClN2O4/c1-30-21-12-9-16(13-22(21)31-2)19(14-27(28)29)23-18-5-3-4-6-20(18)26-24(23)15-7-10-17(25)11-8-15/h3-13,19,26H,14H2,1-2H3