(1-oxidanylidene-1-phenylazanyl-propan-2-yl) 3-methyl-4-nitro-benzoate

Systemtic Name: (1-oxidanylidene-1-phenylazanyl-propan-2-yl) 3-methyl-4-nitro-benzoate Openeye Name: (2-anilino-1-methyl-2-oxo-ethyl) 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid (1-anilino-1-oxopropan-2-yl) ester IUPAC Name: (1-anilino-1-oxopropan-2-yl) 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid (2-anilino-2-keto-1-methyl-ethyl) ester Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC(C)C(=O)NC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC(C)C(=O)NC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O5/c1-11-10-13(8-9-15(11)19(22)23)17(21)24-12(2)16(20)18-14-6-4-3-5-7-14/h3-10,12H,1-2H3,(H,18,20)