methyl 4-chloranyl-3-[(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)oxysulfonyl]benzoate

Systemtic Name: methyl 4-chloranyl-3-[(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)oxysulfonyl]benzoate Openeye Name: methyl 4-chloro-3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxysulfonyl]benzoate CAS Name: 4-chloro-3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxysulfonyl]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxysulfonyl]benzoate Traditional Name: 4-chloro-3-[(2-keto-3,4-dihydro-1H-quinolin-6-yl)oxysulfonyl]benzoic acid methyl ester Formula: C17H14ClNO6S MolecularWeight: 395.81416

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)OC2=CC3=C(C=C2)NC(=O)CC3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)OC2=CC3=C(C=C2)NC(=O)CC3

InChI

InChI=1S/C17H14ClNO6S/c1-24-17(21)11-2-5-13(18)15(9-11)26(22,23)25-12-4-6-14-10(8-12)3-7-16(20)19-14/h2,4-6,8-9H,3,7H2,1H3,(H,19,20)