dimethyl 2-[(3-methyl-4-nitro-phenyl)carbonylamino]hexanedioate

Systemtic Name: dimethyl 2-[(3-methyl-4-nitro-phenyl)carbonylamino]hexanedioate Openeye Name: dimethyl 2-[(3-methyl-4-nitro-benzoyl)amino]hexanedioate CAS Name: 2-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]hexanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(3-methyl-4-nitrobenzoyl)amino]hexanedioate Traditional Name: 2-[(3-methyl-4-nitro-benzoyl)amino]adipic acid dimethyl ester Formula: C16H20N2O7 MolecularWeight: 352.3392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC(CCCC(=O)OC)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC(CCCC(=O)OC)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H20N2O7/c1-10-9-11(7-8-13(10)18(22)23)15(20)17-12(16(21)25-3)5-4-6-14(19)24-2/h7-9,12H,4-6H2,1-3H3,(H,17,20)