[4-(3-azanyl-2-cyano-3-oxidanylidene-prop-1-enyl)-2-methoxy-phenyl] 3,6-bis(chloranyl)-2-methoxy-benzoate

Systemtic Name: [4-(3-azanyl-2-cyano-3-oxidanylidene-prop-1-enyl)-2-methoxy-phenyl] 3,6-bis(chloranyl)-2-methoxy-benzoate Openeye Name: [4-(3-amino-2-cyano-3-oxo-prop-1-enyl)-2-methoxy-phenyl] 3,6-dichloro-2-methoxy-benzoate CAS Name: 3,6-dichloro-2-methoxybenzoic acid [4-(3-amino-2-cyano-3-oxoprop-1-enyl)-2-methoxyphenyl] ester IUPAC Name: [4-(3-amino-2-cyano-3-oxoprop-1-enyl)-2-methoxyphenyl] 3,6-dichloro-2-methoxybenzoate Traditional Name: 3,6-dichloro-2-methoxy-benzoic acid [4-(3-amino-2-cyano-3-keto-prop-1-enyl)-2-methoxy-phenyl] ester Formula: C19H14Cl2N2O5 MolecularWeight: 421.23086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)N)OC(=O)C2=C(C=CC(=C2OC)Cl)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C(=O)N)OC(=O)C2=C(C=CC(=C2OC)Cl)Cl

InChI

InChI=1S/C19H14Cl2N2O5/c1-26-15-8-10(7-11(9-22)18(23)24)3-6-14(15)28-19(25)16-12(20)4-5-13(21)17(16)27-2/h3-8H,1-2H3,(H2,23,24)