N-[2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethylcarbamoyl]phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethylcarbamoyl]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethylcarbamoyl]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethylamino]-oxomethyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethylcarbamoyl]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethylcarbamoyl]phenyl]-piperonylamide Formula: C28H29N3O6 MolecularWeight: 503.54636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CCNC(=O)C3=CC=CC=C3NC(=O)C4=CC5=C(C=C4)OCO5)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CCNC(=O)C3=CC=CC=C3NC(=O)C4=CC5=C(C=C4)OCO5)OC

InChI

InChI=1S/C28H29N3O6/c1-34-24-13-18-9-11-31(16-20(18)15-25(24)35-2)12-10-29-28(33)21-5-3-4-6-22(21)30-27(32)19-7-8-23-26(14-19)37-17-36-23/h3-8,13-15H,9-12,16-17H2,1-2H3,(H,29,33)(H,30,32)