[(1R)-1-(3-nitrophenyl)ethyl] (2R)-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate

Systemtic Name: [(1R)-1-(3-nitrophenyl)ethyl] (2R)-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate Openeye Name: [(1R)-1-(3-nitrophenyl)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 [(1R)-1-(3-nitrophenyl)ethyl] ester IUPAC Name: [(1R)-1-(3-nitrophenyl)ethyl] (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)-1-(3-nitrophenyl)ethyl] ester Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2CN(C3=CC=CC=C3O2)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O6/c1-12(14-6-5-7-15(10-14)21(24)25)26-19(23)18-11-20(13(2)22)16-8-3-4-9-17(16)27-18/h3-10,12,18H,11H2,1-2H3/t12-,18-/m1/s1