[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl] 4-(4-acetyloxy-3-chloranyl-phenyl)benzoate

Systemtic Name: [2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl] 4-(4-acetyloxy-3-chloranyl-phenyl)benzoate Openeye Name: [2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl] 4-(4-acetoxy-3-chloro-phenyl)benzoate CAS Name: 4-(4-acetyloxy-3-chlorophenyl)benzoic acid [2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl] 4-(4-acetyloxy-3-chlorophenyl)benzoate Traditional Name: 4-(4-acetoxy-3-chloro-phenyl)benzoic acid [2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl] ester Formula: C21H17ClN2O6 MolecularWeight: 428.82248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)COC(=O)C2=CC=C(C=C2)C3=CC(=C(C=C3)OC(=O)C)Cl

Isomeric SMILES

CC1=CC(=NO1)NC(=O)COC(=O)C2=CC=C(C=C2)C3=CC(=C(C=C3)OC(=O)C)Cl

InChI

InChI=1S/C21H17ClN2O6/c1-12-9-19(24-30-12)23-20(26)11-28-21(27)15-5-3-14(4-6-15)16-7-8-18(17(22)10-16)29-13(2)25/h3-10H,11H2,1-2H3,(H,23,24,26)