2-methyl-4-oxidanylidene-4-phenyl-3-(piperazin-1-ylmethyl)butanoic acid

Systemtic Name: 2-methyl-4-oxidanylidene-4-phenyl-3-(piperazin-1-ylmethyl)butanoic acid Openeye Name: 2-methyl-4-oxo-4-phenyl-3-(piperazin-1-ylmethyl)butanoic acid CAS Name: 2-methyl-4-oxo-4-phenyl-3-(1-piperazinylmethyl)butanoic acid IUPAC Name: 2-methyl-4-oxo-4-phenyl-3-(piperazin-1-ylmethyl)butanoic acid Traditional Name: 4-keto-2-methyl-4-phenyl-3-(piperazinomethyl)butyric acid Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CN1CCNCC1)C(=O)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C(CN1CCNCC1)C(=O)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H22N2O3/c1-12(16(20)21)14(11-18-9-7-17-8-10-18)15(19)13-5-3-2-4-6-13/h2-6,12,14,17H,7-11H2,1H3,(H,20,21)