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

Systemtic Name: 3-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]-4,6-dimethyl-1H-indole-2-carboxylic acid Openeye Name: 3-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]-4,6-dimethyl-1H-indole-2-carboxylic acid CAS Name: 3-[[4-(3-methoxyphenyl)-1-piperazinyl]methyl]-4,6-dimethyl-1H-indole-2-carboxylic acid IUPAC Name: 3-[[4-(3-methoxyphenyl)piperazin-1-yl]methyl]-4,6-dimethyl-1H-indole-2-carboxylic acid Traditional Name: 3-[[4-(3-methoxyphenyl)piperazino]methyl]-4,6-dimethyl-1H-indole-2-carboxylic acid Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)NC(=C2CN3CCN(CC3)C4=CC(=CC=C4)OC)C(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=C1)NC(=C2CN3CCN(CC3)C4=CC(=CC=C4)OC)C(=O)O)C

InChI

InChI=1S/C23H27N3O3/c1-15-11-16(2)21-19(22(23(27)28)24-20(21)12-15)14-25-7-9-26(10-8-25)17-5-4-6-18(13-17)29-3/h4-6,11-13,24H,7-10,14H2,1-3H3,(H,27,28)