[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 2-chloranyl-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate

Systemtic Name: [2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 2-chloranyl-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate Openeye Name: [2-(3-methoxyphenyl)-2-oxo-ethyl] 2-chloro-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate CAS Name: 2-chloro-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoic acid [2-(3-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methoxyphenyl)-2-oxoethyl] 2-chloro-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate Traditional Name: 2-chloro-5-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoic acid [2-keto-2-(3-methoxyphenyl)ethyl] ester Formula: C25H22ClNO6S MolecularWeight: 499.96328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC4=CC=CC=C43)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC4=CC=CC=C43)Cl

InChI

InChI=1S/C25H22ClNO6S/c1-32-19-9-4-7-18(14-19)24(28)16-33-25(29)21-15-20(11-12-22(21)26)34(30,31)27-13-5-8-17-6-2-3-10-23(17)27/h2-4,6-7,9-12,14-15H,5,8,13,16H2,1H3