3-(3,5-dimethoxyphenyl)-3-(1-ethylindol-3-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(3,5-dimethoxyphenyl)-3-(1-ethylindol-3-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(3,5-dimethoxyphenyl)-3-(1-ethylindol-3-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one CAS Name: 3-(3,5-dimethoxyphenyl)-3-(1-ethyl-3-indolyl)-1-[4-(4-nitrophenyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(3,5-dimethoxyphenyl)-3-(1-ethylindol-3-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(3,5-dimethoxyphenyl)-3-(1-ethylindol-3-yl)-1-[4-(4-nitrophenyl)piperazino]propan-1-one Formula: C31H34N4O5 MolecularWeight: 542.62546

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC(=CC(=C5)OC)OC

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC(=CC(=C5)OC)OC

InChI

InChI=1S/C31H34N4O5/c1-4-32-21-29(27-7-5-6-8-30(27)32)28(22-17-25(39-2)19-26(18-22)40-3)20-31(36)34-15-13-33(14-16-34)23-9-11-24(12-10-23)35(37)38/h5-12,17-19,21,28H,4,13-16,20H2,1-3H3