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

Systemtic Name: 5-[4-(4-cyclohexylphenyl)piperazin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[4-(4-cyclohexylphenyl)piperazin-1-yl]-5-oxo-pentanoic acid CAS Name: 5-[4-(4-cyclohexylphenyl)-1-piperazinyl]-5-oxopentanoic acid IUPAC Name: 5-[4-(4-cyclohexylphenyl)piperazin-1-yl]-5-oxopentanoic acid Traditional Name: 5-[4-(4-cyclohexylphenyl)piperazino]-5-keto-valeric acid Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)N3CCN(CC3)C(=O)CCCC(=O)O

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)N3CCN(CC3)C(=O)CCCC(=O)O

InChI

InChI=1S/C21H30N2O3/c24-20(7-4-8-21(25)26)23-15-13-22(14-16-23)19-11-9-18(10-12-19)17-5-2-1-3-6-17/h9-12,17H,1-8,13-16H2,(H,25,26)