methyl 3,5-diacetamido-4-methyl-2-nitro-benzoate

Systemtic Name: methyl 3,5-diacetamido-4-methyl-2-nitro-benzoate Openeye Name: methyl 3,5-diacetamido-4-methyl-2-nitro-benzoate CAS Name: 3,5-diacetamido-4-methyl-2-nitrobenzoic acid methyl ester IUPAC Name: methyl 3,5-diacetamido-4-methyl-2-nitrobenzoate Traditional Name: 3,5-diacetamido-4-methyl-2-nitro-benzoic acid methyl ester Formula: C13H15N3O6 MolecularWeight: 309.2747

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1NC(=O)C)[N+](=O)[O-])C(=O)OC)NC(=O)C

Isomeric SMILES

CC1=C(C=C(C(=C1NC(=O)C)[N+](=O)[O-])C(=O)OC)NC(=O)C

InChI

InChI=1S/C13H15N3O6/c1-6-10(14-7(2)17)5-9(13(19)22-4)12(16(20)21)11(6)15-8(3)18/h5H,1-4H3,(H,14,17)(H,15,18)