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

Systemtic Name: 5-oxidanylidene-5-[4-(4-phenoxyphenyl)piperazin-1-yl]pentanoic acid Openeye Name: 5-oxo-5-[4-(4-phenoxyphenyl)piperazin-1-yl]pentanoic acid CAS Name: 5-oxo-5-[4-(4-phenoxyphenyl)-1-piperazinyl]pentanoic acid IUPAC Name: 5-oxo-5-[4-(4-phenoxyphenyl)piperazin-1-yl]pentanoic acid Traditional Name: 5-keto-5-[4-(4-phenoxyphenyl)piperazino]valeric acid Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)CCCC(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)CCCC(=O)O

InChI

InChI=1S/C21H24N2O4/c24-20(7-4-8-21(25)26)23-15-13-22(14-16-23)17-9-11-19(12-10-17)27-18-5-2-1-3-6-18/h1-3,5-6,9-12H,4,7-8,13-16H2,(H,25,26)