[1-[(3-chloranyl-4-methoxy-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2-chloranyl-5-nitro-benzoate

Systemtic Name: [1-[(3-chloranyl-4-methoxy-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2-chloranyl-5-nitro-benzoate Openeye Name: [2-(3-chloro-4-methoxy-anilino)-1-methyl-2-oxo-ethyl] 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid [1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-chloro-4-methoxyanilino)-1-oxopropan-2-yl] 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid [2-(3-chloro-4-methoxy-anilino)-2-keto-1-methyl-ethyl] ester Formula: C17H14Cl2N2O6 MolecularWeight: 413.20886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)OC)Cl)OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)OC)Cl)OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H14Cl2N2O6/c1-9(16(22)20-10-3-6-15(26-2)14(19)7-10)27-17(23)12-8-11(21(24)25)4-5-13(12)18/h3-9H,1-2H3,(H,20,22)