ethyl 4-[3-(2,4-dichlorophenyl)propanoylamino]-3-nitro-benzoate

Systemtic Name: ethyl 4-[3-(2,4-dichlorophenyl)propanoylamino]-3-nitro-benzoate Openeye Name: ethyl 4-[3-(2,4-dichlorophenyl)propanoylamino]-3-nitro-benzoate CAS Name: 4-[[3-(2,4-dichlorophenyl)-1-oxopropyl]amino]-3-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(2,4-dichlorophenyl)propanoylamino]-3-nitrobenzoate Traditional Name: 4-[3-(2,4-dichlorophenyl)propanoylamino]-3-nitro-benzoic acid ethyl ester Formula: C18H16Cl2N2O5 MolecularWeight: 411.23604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CCC2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CCC2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H16Cl2N2O5/c1-2-27-18(24)12-4-7-15(16(9-12)22(25)26)21-17(23)8-5-11-3-6-13(19)10-14(11)20/h3-4,6-7,9-10H,2,5,8H2,1H3,(H,21,23)