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

Systemtic Name: [2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Openeye Name: [2-(3-cyanoanilino)-2-oxo-ethyl] 3-ethyl-5-methyl-isoxazole-4-carboxylate CAS Name: 3-ethyl-5-methyl-4-isoxazolecarboxylic acid [2-(3-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-cyanoanilino)-2-oxoethyl] 3-ethyl-5-methyl-1,2-oxazole-4-carboxylate Traditional Name: 3-ethyl-5-methyl-isoxazole-4-carboxylic acid [2-(3-cyanoanilino)-2-keto-ethyl] ester Formula: C16H15N3O4 MolecularWeight: 313.308

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)OCC(=O)NC2=CC=CC(=C2)C#N)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)OCC(=O)NC2=CC=CC(=C2)C#N)C

InChI

InChI=1S/C16H15N3O4/c1-3-13-15(10(2)23-19-13)16(21)22-9-14(20)18-12-6-4-5-11(7-12)8-17/h4-7H,3,9H2,1-2H3,(H,18,20)