5-oxidanylidene-5-[4-[1-(4-propan-2-ylphenyl)ethyl]piperazin-1-yl]pentanoic acid

Systemtic Name: 5-oxidanylidene-5-[4-[1-(4-propan-2-ylphenyl)ethyl]piperazin-1-yl]pentanoic acid Openeye Name: 5-[4-[1-(4-isopropylphenyl)ethyl]piperazin-1-yl]-5-oxo-pentanoic acid CAS Name: 5-oxo-5-[4-[1-(4-propan-2-ylphenyl)ethyl]-1-piperazinyl]pentanoic acid IUPAC Name: 5-oxo-5-[4-[1-(4-propan-2-ylphenyl)ethyl]piperazin-1-yl]pentanoic acid Traditional Name: 5-keto-5-[4-(1-p-cumenylethyl)piperazino]valeric acid Formula: C20H30N2O3 MolecularWeight: 346.4638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C)N2CCN(CC2)C(=O)CCCC(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C)N2CCN(CC2)C(=O)CCCC(=O)O

InChI

InChI=1S/C20H30N2O3/c1-15(2)17-7-9-18(10-8-17)16(3)21-11-13-22(14-12-21)19(23)5-4-6-20(24)25/h7-10,15-16H,4-6,11-14H2,1-3H3,(H,24,25)