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

Systemtic Name: 5-oxidanylidene-5-[4-[4-(phenylmethyl)phenyl]piperazin-1-yl]pentanoic acid Openeye Name: 5-[4-(4-benzylphenyl)piperazin-1-yl]-5-oxo-pentanoic acid CAS Name: 5-oxo-5-[4-[4-(phenylmethyl)phenyl]-1-piperazinyl]pentanoic acid IUPAC Name: 5-[4-(4-benzylphenyl)piperazin-1-yl]-5-oxopentanoic acid Traditional Name: 5-[4-(4-benzylphenyl)piperazino]-5-keto-valeric acid Formula: C22H26N2O3 MolecularWeight: 366.45344

Click to see the large picture

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)