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

Systemtic Name: 4-oxidanylidene-4-[4-[4-(4-phenylpiperazin-1-yl)butyl]phenyl]butanoic acid Openeye Name: 4-oxo-4-[4-[4-(4-phenylpiperazin-1-yl)butyl]phenyl]butanoic acid CAS Name: 4-oxo-4-[4-[4-(4-phenyl-1-piperazinyl)butyl]phenyl]butanoic acid IUPAC Name: 4-oxo-4-[4-[4-(4-phenylpiperazin-1-yl)butyl]phenyl]butanoic acid Traditional Name: 4-keto-4-[4-[4-(4-phenylpiperazino)butyl]phenyl]butyric acid Formula: C24H30N2O3 MolecularWeight: 394.5066

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=CC=C(C=C2)C(=O)CCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCCCC2=CC=C(C=C2)C(=O)CCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C24H30N2O3/c27-23(13-14-24(28)29)21-11-9-20(10-12-21)6-4-5-15-25-16-18-26(19-17-25)22-7-2-1-3-8-22/h1-3,7-12H,4-6,13-19H2,(H,28,29)