(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[3-(phenylsulfonylmethyl)furan-2-yl]methanone

Systemtic Name: (6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[3-(phenylsulfonylmethyl)furan-2-yl]methanone Openeye Name: [3-(benzenesulfonylmethyl)-2-furyl]-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [3-(benzenesulfonylmethyl)-2-furanyl]-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [3-(benzenesulfonylmethyl)furan-2-yl]-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [3-(besylmethyl)-2-furyl]-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C25H27NO6S MolecularWeight: 469.54998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=C(C=CO3)CS(=O)(=O)C4=CC=CC=C4)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=C(C=CO3)CS(=O)(=O)C4=CC=CC=C4)OCC

InChI

InChI=1S/C25H27NO6S/c1-3-30-22-14-18-10-12-26(16-20(18)15-23(22)31-4-2)25(27)24-19(11-13-32-24)17-33(28,29)21-8-6-5-7-9-21/h5-9,11,13-15H,3-4,10,12,16-17H2,1-2H3