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

Systemtic Name: methyl 3-methyl-2-[(3-methyl-2-nitro-phenyl)carbonylamino]butanoate Openeye Name: methyl 3-methyl-2-[(3-methyl-2-nitro-benzoyl)amino]butanoate CAS Name: 3-methyl-2-[[(3-methyl-2-nitrophenyl)-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[(3-methyl-2-nitrobenzoyl)amino]butanoate Traditional Name: 3-methyl-2-[(3-methyl-2-nitro-benzoyl)amino]butyric acid methyl ester Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O5/c1-8(2)11(14(18)21-4)15-13(17)10-7-5-6-9(3)12(10)16(19)20/h5-8,11H,1-4H3,(H,15,17)