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

Systemtic Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(3-pyrrolidin-1-ylsulfonylphenyl)methanone Openeye Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(3-pyrrolidin-1-ylsulfonylphenyl)methanone CAS Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[3-(1-pyrrolidinylsulfonyl)phenyl]methanone IUPAC Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(3-pyrrolidin-1-ylsulfonylphenyl)methanone Traditional Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(3-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(=CC=C3)S(=O)(=O)N4CCCC4)OC

Isomeric SMILES

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

InChI

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