3-[[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]sulfonyl]benzenecarbonitrile

Systemtic Name: 3-[[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]sulfonyl]benzenecarbonitrile Openeye Name: 3-[[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]sulfonyl]benzonitrile CAS Name: 3-[[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]sulfonyl]benzonitrile IUPAC Name: 3-[[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]sulfonyl]benzonitrile Traditional Name: 3-[[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]sulfonyl]benzonitrile Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)S(=O)(=O)C3=CC=CC(=C3)C#N)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)S(=O)(=O)C3=CC=CC(=C3)C#N)C4=CC=CC=C4)OC

InChI

InChI=1S/C24H22N2O4S/c1-29-22-14-19-11-12-26(31(27,28)20-10-6-7-17(13-20)16-25)24(18-8-4-3-5-9-18)21(19)15-23(22)30-2/h3-10,13-15,24H,11-12H2,1-2H3/t24-/m1/s1