5-oxidanylidene-5-[4-[4-(phenylmethyl)phenyl]piperazin-1-yl]pentanoate

Systemtic Name: 5-oxidanylidene-5-[4-[4-(phenylmethyl)phenyl]piperazin-1-yl]pentanoate Openeye Name: 5-[4-(4-benzylphenyl)piperazin-1-yl]-5-oxo-pentanoate CAS Name: 5-oxo-5-[4-[4-(phenylmethyl)phenyl]-1-piperazinyl]pentanoate IUPAC Name: 5-[4-(4-benzylphenyl)piperazin-1-yl]-5-oxopentanoate Traditional Name: 5-[4-(4-benzylphenyl)piperazino]-5-keto-valerate Formula: C22H25N2O3- MolecularWeight: 365.4455

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O3/c25-21(7-4-8-22(26)27)24-15-13-23(14-16-24)20-11-9-19(10-12-20)17-18-5-2-1-3-6-18/h1-3,5-6,9-12H,4,7-8,13-17H2,(H,26,27)/p-1