N-[4-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[4-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-[4-[(1,3-benzodioxol-5-ylamino)-oxomethyl]phenyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-[4-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[4-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C26H25N3O6 MolecularWeight: 475.4932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)NC3=CC=C(C=C3)C(=O)NC4=CC5=C(C=C4)OCO5)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)NC3=CC=C(C=C3)C(=O)NC4=CC5=C(C=C4)OCO5)OC

InChI

InChI=1S/C26H25N3O6/c1-32-22-11-17-9-10-29(14-18(17)12-23(22)33-2)26(31)28-19-5-3-16(4-6-19)25(30)27-20-7-8-21-24(13-20)35-15-34-21/h3-8,11-13H,9-10,14-15H2,1-2H3,(H,27,30)(H,28,31)