1-(4,4-dimethylcyclohexen-1-yl)-3-[(4-methylcyclohexyl)carbonyl-(oxan-4-yl)amino]pyrazole-4-carboxylic acid

Systemtic Name: 1-(4,4-dimethylcyclohexen-1-yl)-3-[(4-methylcyclohexyl)carbonyl-(oxan-4-yl)amino]pyrazole-4-carboxylic acid Openeye Name: 1-(4,4-dimethylcyclohexen-1-yl)-3-[(4-methylcyclohexanecarbonyl)-tetrahydropyran-4-yl-amino]pyrazole-4-carboxylic acid CAS Name: 1-(4,4-dimethyl-1-cyclohexenyl)-3-[[(4-methylcyclohexyl)-oxomethyl]-(4-oxanyl)amino]-4-pyrazolecarboxylic acid IUPAC Name: 1-(4,4-dimethylcyclohexen-1-yl)-3-[(4-methylcyclohexanecarbonyl)-(oxan-4-yl)amino]pyrazole-4-carboxylic acid Traditional Name: 1-(4,4-dimethylcyclohexen-1-yl)-3-[(4-methylcyclohexanecarbonyl)-tetrahydropyran-4-yl-amino]pyrazole-4-carboxylic acid Formula: C25H37N3O4 MolecularWeight: 443.57898

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2CCOCC2)C3=NN(C=C3C(=O)O)C4=CCC(CC4)(C)C

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2CCOCC2)C3=NN(C=C3C(=O)O)C4=CCC(CC4)(C)C

InChI

InChI=1S/C25H37N3O4/c1-17-4-6-18(7-5-17)23(29)28(20-10-14-32-15-11-20)22-21(24(30)31)16-27(26-22)19-8-12-25(2,3)13-9-19/h8,16-18,20H,4-7,9-15H2,1-3H3,(H,30,31)