4-[4-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]phenyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]phenyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-[3-[4-(m-tolyl)piperazin-1-yl]propyl]phenyl]-4-oxo-butanoic acid CAS Name: 4-[4-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]phenyl]-4-oxobutanoic acid IUPAC Name: 4-[4-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]phenyl]-4-oxobutanoic acid Traditional Name: 4-keto-4-[4-[3-[4-(m-tolyl)piperazino]propyl]phenyl]butyric acid Formula: C24H30N2O3 MolecularWeight: 394.5066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCC3=CC=C(C=C3)C(=O)CCC(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCC3=CC=C(C=C3)C(=O)CCC(=O)O

InChI

InChI=1S/C24H30N2O3/c1-19-4-2-6-22(18-19)26-16-14-25(15-17-26)13-3-5-20-7-9-21(10-8-20)23(27)11-12-24(28)29/h2,4,6-10,18H,3,5,11-17H2,1H3,(H,28,29)