2-[1-[2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]cyclopentyl]ethanoic acid

Systemtic Name: 2-[1-[2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]cyclopentyl]ethanoic acid Openeye Name: 2-[1-[2-[4-(4-methylbenzoyl)piperazin-1-yl]-2-oxo-ethyl]cyclopentyl]acetic acid CAS Name: 2-[1-[2-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]-2-oxoethyl]cyclopentyl]acetic acid IUPAC Name: 2-[1-[2-[4-(4-methylbenzoyl)piperazin-1-yl]-2-oxoethyl]cyclopentyl]acetic acid Traditional Name: 2-[1-[2-keto-2-(4-p-toluoylpiperazino)ethyl]cyclopentyl]acetic acid Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CC3(CCCC3)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CC3(CCCC3)CC(=O)O

InChI

InChI=1S/C21H28N2O4/c1-16-4-6-17(7-5-16)20(27)23-12-10-22(11-13-23)18(24)14-21(15-19(25)26)8-2-3-9-21/h4-7H,2-3,8-15H2,1H3,(H,25,26)