[2-[methyl-(2-morpholin-4-yl-2-oxidanylidene-ethyl)amino]-2-oxidanylidene-ethyl] 4-methyl-3-nitro-benzoate

Systemtic Name: [2-[methyl-(2-morpholin-4-yl-2-oxidanylidene-ethyl)amino]-2-oxidanylidene-ethyl] 4-methyl-3-nitro-benzoate Openeye Name: [2-[methyl-(2-morpholino-2-oxo-ethyl)amino]-2-oxo-ethyl] 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid [2-[methyl-[2-(4-morpholinyl)-2-oxoethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-2-oxoethyl] 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-nitro-benzoic acid [2-keto-2-[(2-keto-2-morpholino-ethyl)-methyl-amino]ethyl] ester Formula: C17H21N3O7 MolecularWeight: 379.36454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)N(C)CC(=O)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)N(C)CC(=O)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O7/c1-12-3-4-13(9-14(12)20(24)25)17(23)27-11-16(22)18(2)10-15(21)19-5-7-26-8-6-19/h3-4,9H,5-8,10-11H2,1-2H3