6-chloranyl-2-[(4-methoxycarbonyloxyphenyl)amino]-3-nitro-benzoic acid

Systemtic Name: 6-chloranyl-2-[(4-methoxycarbonyloxyphenyl)amino]-3-nitro-benzoic acid Openeye Name: 6-chloro-2-(4-methoxycarbonyloxyanilino)-3-nitro-benzoic acid CAS Name: 6-chloro-2-(4-methoxycarbonyloxyanilino)-3-nitrobenzoic acid IUPAC Name: 6-chloro-2-(4-methoxycarbonyloxyanilino)-3-nitrobenzoic acid Traditional Name: 2-(4-carbomethoxyoxyanilino)-6-chloro-3-nitro-benzoic acid Formula: C15H11ClN2O7 MolecularWeight: 366.71004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)OC1=CC=C(C=C1)NC2=C(C=CC(=C2C(=O)O)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)OC1=CC=C(C=C1)NC2=C(C=CC(=C2C(=O)O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H11ClN2O7/c1-24-15(21)25-9-4-2-8(3-5-9)17-13-11(18(22)23)7-6-10(16)12(13)14(19)20/h2-7,17H,1H3,(H,19,20)