4-oxidanylidene-4-[4-[4-(phenylmethyl)phenyl]piperazin-1-yl]butanoate

Systemtic Name: 4-oxidanylidene-4-[4-[4-(phenylmethyl)phenyl]piperazin-1-yl]butanoate Openeye Name: 4-[4-(4-benzylphenyl)piperazin-1-yl]-4-oxo-butanoate CAS Name: 4-oxo-4-[4-[4-(phenylmethyl)phenyl]-1-piperazinyl]butanoate IUPAC Name: 4-[4-(4-benzylphenyl)piperazin-1-yl]-4-oxobutanoate Traditional Name: 4-[4-(4-benzylphenyl)piperazino]-4-keto-butyrate Formula: C21H23N2O3- MolecularWeight: 351.41892

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)CC3=CC=CC=C3)C(=O)CCC(=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)CC3=CC=CC=C3)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C21H24N2O3/c24-20(10-11-21(25)26)23-14-12-22(13-15-23)19-8-6-18(7-9-19)16-17-4-2-1-3-5-17/h1-9H,10-16H2,(H,25,26)/p-1