[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidene-4-[(4-phenoxyphenyl)amino]butanoate

Systemtic Name: [2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidene-4-[(4-phenoxyphenyl)amino]butanoate Openeye Name: [2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl] 4-oxo-4-(4-phenoxyanilino)butanoate CAS Name: 4-oxo-4-(4-phenoxyanilino)butanoic acid [2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl] 4-oxo-4-(4-phenoxyanilino)butanoate Traditional Name: 4-keto-4-(4-phenoxyanilino)butyric acid [2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl] ester Formula: C22H21N3O6 MolecularWeight: 423.41864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)COC(=O)CCC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)COC(=O)CCC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C22H21N3O6/c1-15-13-19(25-31-15)24-21(27)14-29-22(28)12-11-20(26)23-16-7-9-18(10-8-16)30-17-5-3-2-4-6-17/h2-10,13H,11-12,14H2,1H3,(H,23,26)(H,24,25,27)