(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 5-(phenylsulfonylmethyl)furan-2-carboxylate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 5-(phenylsulfonylmethyl)furan-2-carboxylate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 5-(benzenesulfonylmethyl)furan-2-carboxylate CAS Name: 5-(benzenesulfonylmethyl)-2-furancarboxylic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 5-(benzenesulfonylmethyl)furan-2-carboxylate Traditional Name: 5-(besylmethyl)furan-2-carboxylic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C23H18ClNO6S MolecularWeight: 471.91012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC=C(O3)CS(=O)(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=CC=C(O3)CS(=O)(=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C23H18ClNO6S/c1-29-17-8-7-15-11-16(22(24)25-20(15)12-17)13-30-23(26)21-10-9-18(31-21)14-32(27,28)19-5-3-2-4-6-19/h2-12H,13-14H2,1H3