1-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]indole-2-carboxylic acid

Systemtic Name: 1-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]indole-2-carboxylic acid Openeye Name: 1-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]indole-2-carboxylic acid CAS Name: 1-methyl-3-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-2-indolecarboxylic acid IUPAC Name: 1-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]indole-2-carboxylic acid Traditional Name: 3-[2-keto-2-(4-methylpiperazino)ethyl]-1-methyl-indole-2-carboxylic acid Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CC2=C(N(C3=CC=CC=C32)C)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C(=O)CC2=C(N(C3=CC=CC=C32)C)C(=O)O

InChI

InChI=1S/C17H21N3O3/c1-18-7-9-20(10-8-18)15(21)11-13-12-5-3-4-6-14(12)19(2)16(13)17(22)23/h3-6H,7-11H2,1-2H3,(H,22,23)