4-[3-(4-methylpiperazin-1-yl)propoxy]-3-(phenylmethyl)-1H-indole-2-carboxylic acid

Systemtic Name: 4-[3-(4-methylpiperazin-1-yl)propoxy]-3-(phenylmethyl)-1H-indole-2-carboxylic acid Openeye Name: 3-benzyl-4-[3-(4-methylpiperazin-1-yl)propoxy]-1H-indole-2-carboxylic acid CAS Name: 4-[3-(4-methyl-1-piperazinyl)propoxy]-3-(phenylmethyl)-1H-indole-2-carboxylic acid IUPAC Name: 3-benzyl-4-[3-(4-methylpiperazin-1-yl)propoxy]-1H-indole-2-carboxylic acid Traditional Name: 3-benzyl-4-[3-(4-methylpiperazino)propoxy]-1H-indole-2-carboxylic acid Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCOC2=CC=CC3=C2C(=C(N3)C(=O)O)CC4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)CCCOC2=CC=CC3=C2C(=C(N3)C(=O)O)CC4=CC=CC=C4

InChI

InChI=1S/C24H29N3O3/c1-26-12-14-27(15-13-26)11-6-16-30-21-10-5-9-20-22(21)19(23(25-20)24(28)29)17-18-7-3-2-4-8-18/h2-5,7-10,25H,6,11-17H2,1H3,(H,28,29)