4-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]-4-(4-propan-2-ylphenyl)butanoic acid

Systemtic Name: 4-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]-4-(4-propan-2-ylphenyl)butanoic acid Openeye Name: 2-(4-benzylpiperazin-1-yl)-4-(4-isopropylphenyl)-4-oxo-butanoic acid CAS Name: 4-oxo-2-[4-(phenylmethyl)-1-piperazinyl]-4-(4-propan-2-ylphenyl)butanoic acid IUPAC Name: 2-(4-benzylpiperazin-1-yl)-4-oxo-4-(4-propan-2-ylphenyl)butanoic acid Traditional Name: 2-(4-benzylpiperazino)-4-keto-4-p-cumenyl-butyric acid Formula: C24H30N2O3 MolecularWeight: 394.5066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)CC(C(=O)O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)CC(C(=O)O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C24H30N2O3/c1-18(2)20-8-10-21(11-9-20)23(27)16-22(24(28)29)26-14-12-25(13-15-26)17-19-6-4-3-5-7-19/h3-11,18,22H,12-17H2,1-2H3,(H,28,29)