methyl 3-[1-ethyl-2-(4-methoxyphenyl)indol-3-yl]-2-(1H-indol-3-yl)-4-nitro-butanoate

Systemtic Name: methyl 3-[1-ethyl-2-(4-methoxyphenyl)indol-3-yl]-2-(1H-indol-3-yl)-4-nitro-butanoate Openeye Name: methyl 3-[1-ethyl-2-(4-methoxyphenyl)indol-3-yl]-2-(1H-indol-3-yl)-4-nitro-butanoate CAS Name: 3-[1-ethyl-2-(4-methoxyphenyl)-3-indolyl]-2-(1H-indol-3-yl)-4-nitrobutanoic acid methyl ester IUPAC Name: methyl 3-[1-ethyl-2-(4-methoxyphenyl)indol-3-yl]-2-(1H-indol-3-yl)-4-nitrobutanoate Traditional Name: 3-[1-ethyl-2-(4-methoxyphenyl)indol-3-yl]-2-(1H-indol-3-yl)-4-nitro-butyric acid methyl ester Formula: C30H29N3O5 MolecularWeight: 511.56836

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C1C3=CC=C(C=C3)OC)C(C[N+](=O)[O-])C(C4=CNC5=CC=CC=C54)C(=O)OC

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C1C3=CC=C(C=C3)OC)C(C[N+](=O)[O-])C(C4=CNC5=CC=CC=C54)C(=O)OC

InChI

InChI=1S/C30H29N3O5/c1-4-32-26-12-8-6-10-22(26)27(29(32)19-13-15-20(37-2)16-14-19)24(18-33(35)36)28(30(34)38-3)23-17-31-25-11-7-5-9-21(23)25/h5-17,24,28,31H,4,18H2,1-3H3