(2-oxidanylidene-2-phenylazanyl-ethyl) 2-(5-methyl-1,2-oxazol-3-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 2-(5-methyl-1,2-oxazol-3-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: (2-anilino-2-oxo-ethyl) 2-(5-methylisoxazol-3-yl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(5-methyl-3-isoxazolyl)-1,3-dioxo-5-isoindolecarboxylic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 2-(5-methyl-1,2-oxazol-3-yl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(5-methylisoxazol-3-yl)isoindoline-5-carboxylic acid (2-anilino-2-keto-ethyl) ester Formula: C21H15N3O6 MolecularWeight: 405.3603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NO1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H15N3O6/c1-12-9-17(23-30-12)24-19(26)15-8-7-13(10-16(15)20(24)27)21(28)29-11-18(25)22-14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H,22,25)