ethyl 4-[3-(3,5-dimethoxyphenyl)-3-(1-ethylindol-3-yl)propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(3,5-dimethoxyphenyl)-3-(1-ethylindol-3-yl)propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(3,5-dimethoxyphenyl)-3-(1-ethylindol-3-yl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-(3,5-dimethoxyphenyl)-3-(1-ethyl-3-indolyl)-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(3,5-dimethoxyphenyl)-3-(1-ethylindol-3-yl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(3,5-dimethoxyphenyl)-3-(1-ethylindol-3-yl)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C28H35N3O5 MolecularWeight: 493.5946

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCN(CC3)C(=O)OCC)C4=CC(=CC(=C4)OC)OC

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C(CC(=O)N3CCN(CC3)C(=O)OCC)C4=CC(=CC(=C4)OC)OC

InChI

InChI=1S/C28H35N3O5/c1-5-29-19-25(23-9-7-8-10-26(23)29)24(20-15-21(34-3)17-22(16-20)35-4)18-27(32)30-11-13-31(14-12-30)28(33)36-6-2/h7-10,15-17,19,24H,5-6,11-14,18H2,1-4H3