4-oxidanylidene-4-[4-[3-(4-phenylpiperazin-1-yl)propyl]phenyl]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[4-[3-(4-phenylpiperazin-1-yl)propyl]phenyl]butanoic acid Openeye Name: 4-oxo-4-[4-[3-(4-phenylpiperazin-1-yl)propyl]phenyl]butanoic acid CAS Name: 4-oxo-4-[4-[3-(4-phenyl-1-piperazinyl)propyl]phenyl]butanoic acid IUPAC Name: 4-oxo-4-[4-[3-(4-phenylpiperazin-1-yl)propyl]phenyl]butanoic acid Traditional Name: 4-keto-4-[4-[3-(4-phenylpiperazino)propyl]phenyl]butyric acid Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2=CC=C(C=C2)C(=O)CCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCCC2=CC=C(C=C2)C(=O)CCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C23H28N2O3/c26-22(12-13-23(27)28)20-10-8-19(9-11-20)5-4-14-24-15-17-25(18-16-24)21-6-2-1-3-7-21/h1-3,6-11H,4-5,12-18H2,(H,27,28)