8-oxidanylidene-8-[4-(4-phenylpiperazin-1-yl)phenyl]octanoic acid

Systemtic Name: 8-oxidanylidene-8-[4-(4-phenylpiperazin-1-yl)phenyl]octanoic acid Openeye Name: 8-oxo-8-[4-(4-phenylpiperazin-1-yl)phenyl]octanoic acid CAS Name: 8-oxo-8-[4-(4-phenyl-1-piperazinyl)phenyl]octanoic acid IUPAC Name: 8-oxo-8-[4-(4-phenylpiperazin-1-yl)phenyl]octanoic acid Traditional Name: 8-keto-8-[4-(4-phenylpiperazino)phenyl]caprylic acid Formula: C24H30N2O3 MolecularWeight: 394.5066

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)CCCCCCC(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)CCCCCCC(=O)O

InChI

InChI=1S/C24H30N2O3/c27-23(10-6-1-2-7-11-24(28)29)20-12-14-22(15-13-20)26-18-16-25(17-19-26)21-8-4-3-5-9-21/h3-5,8-9,12-15H,1-2,6-7,10-11,16-19H2,(H,28,29)