methyl 6-[[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl 6-[[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: methyl 6-[[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: 6-[[[1-(3-methoxy-3-methylbutyl)-4-pyrazolyl]amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl 6-[[1-(3-methoxy-3-methylbutyl)pyrazol-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: 6-[[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C18H27N3O4 MolecularWeight: 349.42468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN1C=C(C=N1)NC(=O)C2CC=CCC2C(=O)OC)OC

Isomeric SMILES

CC(C)(CCN1C=C(C=N1)NC(=O)C2CC=CCC2C(=O)OC)OC

InChI

InChI=1S/C18H27N3O4/c1-18(2,25-4)9-10-21-12-13(11-19-21)20-16(22)14-7-5-6-8-15(14)17(23)24-3/h5-6,11-12,14-15H,7-10H2,1-4H3,(H,20,22)