2-[4-(4-propylphenyl)piperazin-1-yl]carbonylcyclohexane-1-carboxylic acid

Systemtic Name: 2-[4-(4-propylphenyl)piperazin-1-yl]carbonylcyclohexane-1-carboxylic acid Openeye Name: 2-[4-(4-propylphenyl)piperazine-1-carbonyl]cyclohexanecarboxylic acid CAS Name: 2-[oxo-[4-(4-propylphenyl)-1-piperazinyl]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[4-(4-propylphenyl)piperazine-1-carbonyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[4-(4-propylphenyl)piperazine-1-carbonyl]cyclohexanecarboxylic acid Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3CCCCC3C(=O)O

Isomeric SMILES

CCCC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3CCCCC3C(=O)O

InChI

InChI=1S/C21H30N2O3/c1-2-5-16-8-10-17(11-9-16)22-12-14-23(15-13-22)20(24)18-6-3-4-7-19(18)21(25)26/h8-11,18-19H,2-7,12-15H2,1H3,(H,25,26)