[(2R)-1-[(4-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] (2R)-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate

Systemtic Name: [(2R)-1-[(4-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] (2R)-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate Openeye Name: [(1R)-2-(4-methoxyanilino)-1-methyl-2-oxo-ethyl] (2R)-4-acetyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate CAS Name: (2R)-4-acetyl-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid [(2R)-1-(4-methoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-methoxyanilino)-1-oxopropan-2-yl] (2R)-4-acetyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate Traditional Name: (2R)-4-acetyl-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid [(1R)-2-keto-1-methyl-2-(p-anisidino)ethyl] ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC)OC(=O)C2CN(C3=CC=CC=C3O2)C(=O)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)OC)OC(=O)[C@H]2CN(C3=CC=CC=C3O2)C(=O)C

InChI

InChI=1S/C21H22N2O6/c1-13(20(25)22-15-8-10-16(27-3)11-9-15)28-21(26)19-12-23(14(2)24)17-6-4-5-7-18(17)29-19/h4-11,13,19H,12H2,1-3H3,(H,22,25)/t13-,19-/m1/s1