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

Systemtic Name: 1-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]phenyl]piperidin-2-one Openeye Name: 1-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]phenyl]piperidin-2-one CAS Name: 1-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]phenyl]-2-piperidinone IUPAC Name: 1-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]phenyl]piperidin-2-one Traditional Name: 1-[4-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]phenyl]-2-piperidone Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)C3=CC=C(C=C3)N4CCCCC4=O)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)C3=CC=C(C=C3)N4CCCCC4=O)OC

InChI

InChI=1S/C22H26N2O5S/c1-28-20-13-16-10-12-23(15-17(16)14-21(20)29-2)30(26,27)19-8-6-18(7-9-19)24-11-4-3-5-22(24)25/h6-9,13-14H,3-5,10-12,15H2,1-2H3