(1R)-6,7-dimethoxy-1-phenyl-2-pyrrolidin-1-ylsulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: (1R)-6,7-dimethoxy-1-phenyl-2-pyrrolidin-1-ylsulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: (1R)-6,7-dimethoxy-1-phenyl-2-pyrrolidin-1-ylsulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: (1R)-6,7-dimethoxy-1-phenyl-2-(1-pyrrolidinylsulfonyl)-3,4-dihydro-1H-isoquinoline IUPAC Name: (1R)-6,7-dimethoxy-1-phenyl-2-pyrrolidin-1-ylsulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: (1R)-6,7-dimethoxy-1-phenyl-2-pyrrolidinosulfonyl-3,4-dihydro-1H-isoquinoline Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)S(=O)(=O)N3CCCC3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)S(=O)(=O)N3CCCC3)C4=CC=CC=C4)OC

InChI

InChI=1S/C21H26N2O4S/c1-26-19-14-17-10-13-23(28(24,25)22-11-6-7-12-22)21(16-8-4-3-5-9-16)18(17)15-20(19)27-2/h3-5,8-9,14-15,21H,6-7,10-13H2,1-2H3/t21-/m1/s1