1-[3-[(4-methylcyclohexyl)amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 1-[3-[(4-methylcyclohexyl)amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 1-[3-[(4-methylcyclohexyl)amino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 1-[3-[(4-methylcyclohexyl)amino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 1-[3-[(4-methylcyclohexyl)amino]-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 1-[3-keto-3-[(4-methylcyclohexyl)amino]propyl]pyrazole-3-carboxylic acid Formula: C14H21N3O3 MolecularWeight: 279.33484

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)CCN2C=CC(=N2)C(=O)O

Isomeric SMILES

CC1CCC(CC1)NC(=O)CCN2C=CC(=N2)C(=O)O

InChI

InChI=1S/C14H21N3O3/c1-10-2-4-11(5-3-10)15-13(18)7-9-17-8-6-12(16-17)14(19)20/h6,8,10-11H,2-5,7,9H2,1H3,(H,15,18)(H,19,20)