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

Systemtic Name: 1-methyl-3-[2-oxidanylidene-2-[2-(4-phenylpiperazin-1-yl)ethylamino]ethyl]indole-2-carboxylic acid Openeye Name: 1-methyl-3-[2-oxo-2-[2-(4-phenylpiperazin-1-yl)ethylamino]ethyl]indole-2-carboxylic acid CAS Name: 1-methyl-3-[2-oxo-2-[2-(4-phenyl-1-piperazinyl)ethylamino]ethyl]-2-indolecarboxylic acid IUPAC Name: 1-methyl-3-[2-oxo-2-[2-(4-phenylpiperazin-1-yl)ethylamino]ethyl]indole-2-carboxylic acid Traditional Name: 3-[2-keto-2-[2-(4-phenylpiperazino)ethylamino]ethyl]-1-methyl-indole-2-carboxylic acid Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)NCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)NCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4O3/c1-26-21-10-6-5-9-19(21)20(23(26)24(30)31)17-22(29)25-11-12-27-13-15-28(16-14-27)18-7-3-2-4-8-18/h2-10H,11-17H2,1H3,(H,25,29)(H,30,31)