[2-(4-ethoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-(4-methylpiperidin-1-yl)methanone

Systemtic Name: [2-(4-ethoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-(4-methylpiperidin-1-yl)methanone Openeye Name: [2-(4-ethoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-(4-methyl-1-piperidyl)methanone CAS Name: [2-(4-ethoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-(4-methyl-1-piperidinyl)methanone IUPAC Name: [2-(4-ethoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-3-yl]-(4-methylpiperidin-1-yl)methanone Traditional Name: (4-methylpiperidino)-(2-p-phenetylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone Formula: C24H30N2O4S MolecularWeight: 442.571

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)N4CCC(CC4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)N4CCC(CC4)C

InChI

InChI=1S/C24H30N2O4S/c1-3-30-21-8-10-22(11-9-21)31(28,29)26-17-20-7-5-4-6-19(20)16-23(26)24(27)25-14-12-18(2)13-15-25/h4-11,18,23H,3,12-17H2,1-2H3