ethyl 5-(2-methylprop-2-enoylamino)-3-oxidanylidene-2-phenyl-pyrazole-1-carboxylate

Systemtic Name: ethyl 5-(2-methylprop-2-enoylamino)-3-oxidanylidene-2-phenyl-pyrazole-1-carboxylate Openeye Name: ethyl 5-(2-methylprop-2-enoylamino)-3-oxo-2-phenyl-pyrazole-1-carboxylate CAS Name: 5-[(2-methyl-1-oxoprop-2-enyl)amino]-3-oxo-2-phenyl-1-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-methylprop-2-enoylamino)-3-oxo-2-phenylpyrazole-1-carboxylate Traditional Name: 3-keto-5-methacrylamido-2-phenyl-3-pyrazoline-1-carboxylic acid ethyl ester Formula: C16H17N3O4 MolecularWeight: 315.32388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(=CC(=O)N1C2=CC=CC=C2)NC(=O)C(=C)C

Isomeric SMILES

CCOC(=O)N1C(=CC(=O)N1C2=CC=CC=C2)NC(=O)C(=C)C

InChI

InChI=1S/C16H17N3O4/c1-4-23-16(22)19-13(17-15(21)11(2)3)10-14(20)18(19)12-8-6-5-7-9-12/h5-10H,2,4H2,1,3H3,(H,17,21)