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

Systemtic Name: 1-ethyl-3-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]indole-2-carboxylic acid Openeye Name: 1-ethyl-3-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]indole-2-carboxylic acid CAS Name: 1-ethyl-3-[2-[4-(2-fluorophenyl)-1-piperazinyl]-2-oxoethyl]-2-indolecarboxylic acid IUPAC Name: 1-ethyl-3-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl]indole-2-carboxylic acid Traditional Name: 1-ethyl-3-[2-[4-(2-fluorophenyl)piperazino]-2-keto-ethyl]indole-2-carboxylic acid Formula: C23H24FN3O3 MolecularWeight: 409.453363

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C23H24FN3O3/c1-2-27-19-9-5-3-7-16(19)17(22(27)23(29)30)15-21(28)26-13-11-25(12-14-26)20-10-6-4-8-18(20)24/h3-10H,2,11-15H2,1H3,(H,29,30)