methyl 3-[2-(2-chloranyl-5-nitro-phenyl)carbonyloxyethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-(2-chloranyl-5-nitro-phenyl)carbonyloxyethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-(2-chloro-5-nitro-benzoyl)oxyacetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[(2-chloro-5-nitrophenyl)-oxomethoxy]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-(2-chloro-5-nitrobenzoyl)oxyacetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-(2-chloro-5-nitro-benzoyl)oxyacetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C18H15ClN2O7 MolecularWeight: 406.7739

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H15ClN2O7/c1-10-3-4-11(17(23)27-2)7-15(10)20-16(22)9-28-18(24)13-8-12(21(25)26)5-6-14(13)19/h3-8H,9H2,1-2H3,(H,20,22)