(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-[(4-cyanophenyl)sulfonylamino]ethanoate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-[(4-cyanophenyl)sulfonylamino]ethanoate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 2-[(4-cyanophenyl)sulfonylamino]acetate CAS Name: 2-[(4-cyanophenyl)sulfonylamino]acetic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 2-[(4-cyanophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-cyanophenyl)sulfonylamino]acetic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C20H16ClN3O5S MolecularWeight: 445.87614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)CNS(=O)(=O)C3=CC=C(C=C3)C#N)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)CNS(=O)(=O)C3=CC=C(C=C3)C#N)Cl

InChI

InChI=1S/C20H16ClN3O5S/c1-28-16-5-4-14-8-15(20(21)24-18(14)9-16)12-29-19(25)11-23-30(26,27)17-6-2-13(10-22)3-7-17/h2-9,23H,11-12H2,1H3