[2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl] 3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxylate

Systemtic Name: [2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl] 3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxylate Openeye Name: [2-(2-cyanoanilino)-2-oxo-ethyl] 5-isopropyl-3-methyl-isoxazole-4-carboxylate CAS Name: 3-methyl-5-propan-2-yl-4-isoxazolecarboxylic acid [2-(2-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoanilino)-2-oxoethyl] 3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxylate Traditional Name: 5-isopropyl-3-methyl-isoxazole-4-carboxylic acid [2-(2-cyanoanilino)-2-keto-ethyl] ester Formula: C17H17N3O4 MolecularWeight: 327.33458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)OCC(=O)NC2=CC=CC=C2C#N)C(C)C

Isomeric SMILES

CC1=NOC(=C1C(=O)OCC(=O)NC2=CC=CC=C2C#N)C(C)C

InChI

InChI=1S/C17H17N3O4/c1-10(2)16-15(11(3)20-24-16)17(22)23-9-14(21)19-13-7-5-4-6-12(13)8-18/h4-7,10H,9H2,1-3H3,(H,19,21)