methyl 2-[(4-acetamidophenyl)amino]-5-nitro-benzoate

Systemtic Name: methyl 2-[(4-acetamidophenyl)amino]-5-nitro-benzoate Openeye Name: methyl 2-(4-acetamidoanilino)-5-nitro-benzoate CAS Name: 2-(4-acetamidoanilino)-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-(4-acetamidoanilino)-5-nitrobenzoate Traditional Name: 2-(4-acetamidoanilino)-5-nitro-benzoic acid methyl ester Formula: C16H15N3O5 MolecularWeight: 329.3074

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C16H15N3O5/c1-10(20)17-11-3-5-12(6-4-11)18-15-8-7-13(19(22)23)9-14(15)16(21)24-2/h3-9,18H,1-2H3,(H,17,20)