1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(6-ethoxy-3-methyl-quinolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(6-ethoxy-3-methyl-quinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-ethoxy-3-methyl-2-quinolyl)sulfanyl]ethanone CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-ethoxy-3-methyl-2-quinolinyl)thio]ethanone IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(6-ethoxy-3-methylquinolin-2-yl)sulfanylethanone Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-ethoxy-3-methyl-2-quinolyl)thio]ethanone Formula: C22H21NO4S MolecularWeight: 395.47144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC(=C(N=C2C=C1)SCC(=O)C3=CC4=C(C=C3)OCCO4)C

Isomeric SMILES

CCOC1=CC2=CC(=C(N=C2C=C1)SCC(=O)C3=CC4=C(C=C3)OCCO4)C

InChI

InChI=1S/C22H21NO4S/c1-3-25-17-5-6-18-16(11-17)10-14(2)22(23-18)28-13-19(24)15-4-7-20-21(12-15)27-9-8-26-20/h4-7,10-12H,3,8-9,13H2,1-2H3