methyl 2-(2-methylpropylamino)-4-nitro-benzoate

Systemtic Name: methyl 2-(2-methylpropylamino)-4-nitro-benzoate Openeye Name: methyl 2-(isobutylamino)-4-nitro-benzoate CAS Name: 2-(2-methylpropylamino)-4-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-(2-methylpropylamino)-4-nitrobenzoate Traditional Name: 2-(isobutylamino)-4-nitro-benzoic acid methyl ester Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(C)CNC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C12H16N2O4/c1-8(2)7-13-11-6-9(14(16)17)4-5-10(11)12(15)18-3/h4-6,8,13H,7H2,1-3H3