ethyl 1-[2-[1-(3-methylphenyl)pyrazol-3-yl]ethanoylamino]cyclohexane-1-carboxylate

Systemtic Name: ethyl 1-[2-[1-(3-methylphenyl)pyrazol-3-yl]ethanoylamino]cyclohexane-1-carboxylate Openeye Name: ethyl 1-[[2-[1-(m-tolyl)pyrazol-3-yl]acetyl]amino]cyclohexanecarboxylate CAS Name: 1-[[2-[1-(3-methylphenyl)-3-pyrazolyl]-1-oxoethyl]amino]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[2-[1-(3-methylphenyl)pyrazol-3-yl]acetyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[2-[1-(m-tolyl)pyrazol-3-yl]acetyl]amino]cyclohexanecarboxylic acid ethyl ester Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCCC1)NC(=O)CC2=NN(C=C2)C3=CC=CC(=C3)C

Isomeric SMILES

CCOC(=O)C1(CCCCC1)NC(=O)CC2=NN(C=C2)C3=CC=CC(=C3)C

InChI

InChI=1S/C21H27N3O3/c1-3-27-20(26)21(11-5-4-6-12-21)22-19(25)15-17-10-13-24(23-17)18-9-7-8-16(2)14-18/h7-10,13-14H,3-6,11-12,15H2,1-2H3,(H,22,25)