2-[(2-methyl-4-nitro-phenyl)-propanoyl-carbamoyl]benzoate

Systemtic Name: 2-[(2-methyl-4-nitro-phenyl)-propanoyl-carbamoyl]benzoate Openeye Name: 2-[(2-methyl-4-nitro-phenyl)-propanoyl-carbamoyl]benzoate CAS Name: 2-[[2-methyl-4-nitro-N-(1-oxopropyl)anilino]-oxomethyl]benzoate IUPAC Name: 2-[(2-methyl-4-nitrophenyl)-propanoylcarbamoyl]benzoate Traditional Name: 2-[(2-methyl-4-nitro-phenyl)-propionyl-carbamoyl]benzoate Formula: C18H15N2O6- MolecularWeight: 355.3215

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=C(C=C(C=C1)[N+](=O)[O-])C)C(=O)C2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

CCC(=O)N(C1=C(C=C(C=C1)[N+](=O)[O-])C)C(=O)C2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C18H16N2O6/c1-3-16(21)19(15-9-8-12(20(25)26)10-11(15)2)17(22)13-6-4-5-7-14(13)18(23)24/h4-10H,3H2,1-2H3,(H,23,24)/p-1