methyl 4-[6,7-bis(chloranyl)-3-cyano-quinoxalin-2-yl]benzoate

Systemtic Name: methyl 4-[6,7-bis(chloranyl)-3-cyano-quinoxalin-2-yl]benzoate Openeye Name: methyl 4-(6,7-dichloro-3-cyano-quinoxalin-2-yl)benzoate CAS Name: 4-(6,7-dichloro-3-cyano-2-quinoxalinyl)benzoic acid methyl ester IUPAC Name: methyl 4-(6,7-dichloro-3-cyanoquinoxalin-2-yl)benzoate Traditional Name: 4-(6,7-dichloro-3-cyano-quinoxalin-2-yl)benzoic acid methyl ester Formula: C17H9Cl2N3O2 MolecularWeight: 358.17826

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=NC3=CC(=C(C=C3N=C2C#N)Cl)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=NC3=CC(=C(C=C3N=C2C#N)Cl)Cl

InChI

InChI=1S/C17H9Cl2N3O2/c1-24-17(23)10-4-2-9(3-5-10)16-15(8-20)21-13-6-11(18)12(19)7-14(13)22-16/h2-7H,1H3