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

Systemtic Name: methyl 3-[2-(4-azanyl-3-nitro-phenyl)carbonyloxyethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-(4-amino-3-nitro-benzoyl)oxyacetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[(4-amino-3-nitrophenyl)-oxomethoxy]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-amino-3-nitrobenzoyl)oxyacetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-(4-amino-3-nitro-benzoyl)oxyacetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C18H17N3O7 MolecularWeight: 387.34348

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O7/c1-10-3-4-11(17(23)27-2)7-14(10)20-16(22)9-28-18(24)12-5-6-13(19)15(8-12)21(25)26/h3-8H,9,19H2,1-2H3,(H,20,22)