[(1R)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl] 2-azanyl-4-nitro-benzoate

Systemtic Name: [(1R)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl] 2-azanyl-4-nitro-benzoate Openeye Name: [(1R)-2-morpholino-2-oxo-1-phenyl-ethyl] 2-amino-4-nitro-benzoate CAS Name: 2-amino-4-nitrobenzoic acid [(1R)-2-(4-morpholinyl)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-morpholin-4-yl-2-oxo-1-phenylethyl] 2-amino-4-nitrobenzoate Traditional Name: 2-amino-4-nitro-benzoic acid [(1R)-2-keto-2-morpholino-1-phenyl-ethyl] ester Formula: C19H19N3O6 MolecularWeight: 385.37066

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C(C2=CC=CC=C2)OC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])N

Isomeric SMILES

C1COCCN1C(=O)[C@@H](C2=CC=CC=C2)OC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])N

InChI

InChI=1S/C19H19N3O6/c20-16-12-14(22(25)26)6-7-15(16)19(24)28-17(13-4-2-1-3-5-13)18(23)21-8-10-27-11-9-21/h1-7,12,17H,8-11,20H2/t17-/m1/s1