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

Systemtic Name: methyl 4-[(2-methyl-3-nitro-phenyl)carbonylamino]butanoate Openeye Name: methyl 4-[(2-methyl-3-nitro-benzoyl)amino]butanoate CAS Name: 4-[[(2-methyl-3-nitrophenyl)-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(2-methyl-3-nitrobenzoyl)amino]butanoate Traditional Name: 4-[(2-methyl-3-nitro-benzoyl)amino]butyric acid methyl ester Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O5/c1-9-10(5-3-6-11(9)15(18)19)13(17)14-8-4-7-12(16)20-2/h3,5-6H,4,7-8H2,1-2H3,(H,14,17)