3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1-ethyl-indole-2-carboxylic acid

Systemtic Name: 3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1-ethyl-indole-2-carboxylic acid Openeye Name: 3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]-1-ethyl-indole-2-carboxylic acid CAS Name: 3-[2-[4-(3-chlorophenyl)-1-piperazinyl]-2-oxoethyl]-1-ethyl-2-indolecarboxylic acid IUPAC Name: 3-[2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl]-1-ethylindole-2-carboxylic acid Traditional Name: 3-[2-[4-(3-chlorophenyl)piperazino]-2-keto-ethyl]-1-ethyl-indole-2-carboxylic acid Formula: C23H24ClN3O3 MolecularWeight: 425.90796

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H24ClN3O3/c1-2-27-20-9-4-3-8-18(20)19(22(27)23(29)30)15-21(28)26-12-10-25(11-13-26)17-7-5-6-16(24)14-17/h3-9,14H,2,10-13,15H2,1H3,(H,29,30)