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

Systemtic Name: (1-oxidanylidene-1-phenylazanyl-propan-2-yl) 4-(cyclopropylamino)-3-nitro-benzoate Openeye Name: (2-anilino-1-methyl-2-oxo-ethyl) 4-(cyclopropylamino)-3-nitro-benzoate CAS Name: 4-(cyclopropylamino)-3-nitrobenzoic acid (1-anilino-1-oxopropan-2-yl) ester IUPAC Name: (1-anilino-1-oxopropan-2-yl) 4-(cyclopropylamino)-3-nitrobenzoate Traditional Name: 4-(cyclopropylamino)-3-nitro-benzoic acid (2-anilino-2-keto-1-methyl-ethyl) ester Formula: C19H19N3O5 MolecularWeight: 369.37126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O5/c1-12(18(23)21-14-5-3-2-4-6-14)27-19(24)13-7-10-16(20-15-8-9-15)17(11-13)22(25)26/h2-7,10-12,15,20H,8-9H2,1H3,(H,21,23)