N-[4-[(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)methylsulfonyl]phenyl]ethanamide

Systemtic Name: N-[4-[(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)methylsulfonyl]phenyl]ethanamide Openeye Name: N-[4-[(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)methylsulfonyl]phenyl]acetamide CAS Name: N-[4-[(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)methylsulfonyl]phenyl]acetamide IUPAC Name: N-[4-[(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)methylsulfonyl]phenyl]acetamide Traditional Name: N-[4-[(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)methylsulfonyl]phenyl]acetamide Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)CC2=NCCC3=CC(=C(C=C32)OC)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)CC2=NCCC3=CC(=C(C=C32)OC)OC

InChI

InChI=1S/C20H22N2O5S/c1-13(23)22-15-4-6-16(7-5-15)28(24,25)12-18-17-11-20(27-3)19(26-2)10-14(17)8-9-21-18/h4-7,10-11H,8-9,12H2,1-3H3,(H,22,23)