methyl 1-[2-(1-phenylpyrazol-4-yl)ethanoylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[2-(1-phenylpyrazol-4-yl)ethanoylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[2-(1-phenylpyrazol-4-yl)acetyl]amino]cyclohexanecarboxylate CAS Name: 1-[[1-oxo-2-(1-phenyl-4-pyrazolyl)ethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-(1-phenylpyrazol-4-yl)acetyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[2-(1-phenylpyrazol-4-yl)acetyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H23N3O3/c1-25-18(24)19(10-6-3-7-11-19)21-17(23)12-15-13-20-22(14-15)16-8-4-2-5-9-16/h2,4-5,8-9,13-14H,3,6-7,10-12H2,1H3,(H,21,23)