methyl 2-[(1-azanyl-2,3-dimethyl-1-oxidanylidene-butan-2-yl)carbamoyl]-6-nitro-benzoate

Systemtic Name: methyl 2-[(1-azanyl-2,3-dimethyl-1-oxidanylidene-butan-2-yl)carbamoyl]-6-nitro-benzoate Openeye Name: methyl 2-[(1-carbamoyl-1,2-dimethyl-propyl)carbamoyl]-6-nitro-benzoate CAS Name: 2-[[(1-amino-2,3-dimethyl-1-oxobutan-2-yl)amino]-oxomethyl]-6-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-[(1-amino-2,3-dimethyl-1-oxobutan-2-yl)carbamoyl]-6-nitrobenzoate Traditional Name: 2-[(1-carbamoyl-1,2-dimethyl-propyl)carbamoyl]-6-nitro-benzoic acid methyl ester Formula: C15H19N3O6 MolecularWeight: 337.32786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O6/c1-8(2)15(3,14(16)21)17-12(19)9-6-5-7-10(18(22)23)11(9)13(20)24-4/h5-8H,1-4H3,(H2,16,21)(H,17,19)