(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]methanone

Systemtic Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]methanone Openeye Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-[(E)-styryl]sulfonyl-4-piperidyl]methanone CAS Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinyl]methanone IUPAC Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]methanone Traditional Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-[(E)-styryl]sulfonyl-4-piperidyl]methanone Formula: C25H30N2O5S MolecularWeight: 470.5811

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3CCN(CC3)S(=O)(=O)C=CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3CCN(CC3)S(=O)(=O)/C=C/C4=CC=CC=C4)OC

InChI

InChI=1S/C25H30N2O5S/c1-31-23-16-21-8-12-26(18-22(21)17-24(23)32-2)25(28)20-9-13-27(14-10-20)33(29,30)15-11-19-6-4-3-5-7-19/h3-7,11,15-17,20H,8-10,12-14,18H2,1-2H3/b15-11+