3-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1-methyl-indole-2-carboxylate

Systemtic Name: 3-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1-methyl-indole-2-carboxylate Openeye Name: 3-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]-1-methyl-indole-2-carboxylate CAS Name: 3-[2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxoethyl]-1-methyl-2-indolecarboxylate IUPAC Name: 3-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl]-1-methylindole-2-carboxylate Traditional Name: 3-[2-[4-(4-fluorophenyl)piperazino]-2-keto-ethyl]-1-methyl-indole-2-carboxylate Formula: C22H21FN3O3- MolecularWeight: 394.418843

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C(=O)[O-])CC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C(=O)[O-])CC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H22FN3O3/c1-24-19-5-3-2-4-17(19)18(21(24)22(28)29)14-20(27)26-12-10-25(11-13-26)16-8-6-15(23)7-9-16/h2-9H,10-14H2,1H3,(H,28,29)/p-1