ethyl 3-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]-4,6-dimethyl-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]-4,6-dimethyl-1H-indole-2-carboxylate Openeye Name: ethyl 3-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]-4,6-dimethyl-1H-indole-2-carboxylate CAS Name: 3-[[4-(3-methoxyphenyl)-1-piperazinyl]methyl]-4,6-dimethyl-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]-4,6-dimethyl-1H-indole-2-carboxylate Traditional Name: 3-[[4-(3-methoxyphenyl)piperazino]methyl]-4,6-dimethyl-1H-indole-2-carboxylic acid ethyl ester Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=C(C=C2N1)C)C)CN3CCN(CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=C(C=C2N1)C)C)CN3CCN(CC3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C25H31N3O3/c1-5-31-25(29)24-21(23-18(3)13-17(2)14-22(23)26-24)16-27-9-11-28(12-10-27)19-7-6-8-20(15-19)30-4/h6-8,13-15,26H,5,9-12,16H2,1-4H3