6-chloranyl-4-methyl-7-[2-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-2-oxidanylidene-ethoxy]chromen-2-one

Systemtic Name: 6-chloranyl-4-methyl-7-[2-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-2-oxidanylidene-ethoxy]chromen-2-one Openeye Name: 6-chloro-4-methyl-7-[2-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-2-oxo-ethoxy]chromen-2-one CAS Name: 6-chloro-4-methyl-7-[2-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-2-oxoethoxy]-1-benzopyran-2-one IUPAC Name: 6-chloro-4-methyl-7-[2-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-2-oxoethoxy]chromen-2-one Traditional Name: 6-chloro-7-[2-keto-2-(1-mesyl-3,4-dihydro-2H-quinolin-6-yl)ethoxy]-4-methyl-coumarin Formula: C22H20ClNO6S MolecularWeight: 461.9153

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)C3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)C3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C

InChI

InChI=1S/C22H20ClNO6S/c1-13-8-22(26)30-20-11-21(17(23)10-16(13)20)29-12-19(25)15-5-6-18-14(9-15)4-3-7-24(18)31(2,27)28/h5-6,8-11H,3-4,7,12H2,1-2H3