(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(4-pyrrolidin-1-ylsulfonylphenyl)methanone

Systemtic Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Openeye Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(4-pyrrolidin-1-ylsulfonylphenyl)methanone CAS Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[4-(1-pyrrolidinylsulfonyl)phenyl]methanone IUPAC Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Traditional Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(4-pyrrolidinosulfonylphenyl)methanone Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)OC

InChI

InChI=1S/C22H26N2O5S/c1-28-20-13-17-9-12-23(15-18(17)14-21(20)29-2)22(25)16-5-7-19(8-6-16)30(26,27)24-10-3-4-11-24/h5-8,13-14H,3-4,9-12,15H2,1-2H3