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

Systemtic Name: [1-[[2,5-bis(chloranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 5-ethoxy-4-methoxy-2-nitro-benzoate Openeye Name: [2-(2,5-dichloroanilino)-1-methyl-2-oxo-ethyl] 5-ethoxy-4-methoxy-2-nitro-benzoate CAS Name: 5-ethoxy-4-methoxy-2-nitrobenzoic acid [1-(2,5-dichloroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,5-dichloroanilino)-1-oxopropan-2-yl] 5-ethoxy-4-methoxy-2-nitrobenzoate Traditional Name: 5-ethoxy-4-methoxy-2-nitro-benzoic acid [2-(2,5-dichloroanilino)-2-keto-1-methyl-ethyl] ester Formula: C19H18Cl2N2O7 MolecularWeight: 457.26142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)OC(C)C(=O)NC2=C(C=CC(=C2)Cl)Cl)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)OC(C)C(=O)NC2=C(C=CC(=C2)Cl)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C19H18Cl2N2O7/c1-4-29-17-8-12(15(23(26)27)9-16(17)28-3)19(25)30-10(2)18(24)22-14-7-11(20)5-6-13(14)21/h5-10H,4H2,1-3H3,(H,22,24)