methyl 3-[[1,4-bis(chloranyl)isoquinolin-7-yl]sulfonylamino]-4-methoxy-benzoate

Systemtic Name: methyl 3-[[1,4-bis(chloranyl)isoquinolin-7-yl]sulfonylamino]-4-methoxy-benzoate Openeye Name: methyl 3-[(1,4-dichloro-7-isoquinolyl)sulfonylamino]-4-methoxy-benzoate CAS Name: 3-[(1,4-dichloro-7-isoquinolinyl)sulfonylamino]-4-methoxybenzoic acid methyl ester IUPAC Name: methyl 3-[(1,4-dichloroisoquinolin-7-yl)sulfonylamino]-4-methoxybenzoate Traditional Name: 3-[(1,4-dichloro-7-isoquinolyl)sulfonylamino]-4-methoxy-benzoic acid methyl ester Formula: C18H14Cl2N2O5S MolecularWeight: 441.28516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC)NS(=O)(=O)C2=CC3=C(C=C2)C(=CN=C3Cl)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC)NS(=O)(=O)C2=CC3=C(C=C2)C(=CN=C3Cl)Cl

InChI

InChI=1S/C18H14Cl2N2O5S/c1-26-16-6-3-10(18(23)27-2)7-15(16)22-28(24,25)11-4-5-12-13(8-11)17(20)21-9-14(12)19/h3-9,22H,1-2H3