N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-methyl-3-(1-methylindol-3-yl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-methyl-3-(1-methylindol-3-yl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-methyl-3-(1-methylindol-3-yl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-methyl-3-(1-methyl-3-indolyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-methyl-3-(1-methylindol-3-yl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-keto-2-methyl-3-(1-methylindol-3-yl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C29H27N3O4 MolecularWeight: 481.54238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C3C(C4=CC=CC=C4C(=O)N3C)C(=O)NCC5COC6=CC=CC=C6O5

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C3C(C4=CC=CC=C4C(=O)N3C)C(=O)NCC5COC6=CC=CC=C6O5

InChI

InChI=1S/C29H27N3O4/c1-31-16-22(19-9-5-6-12-23(19)31)27-26(20-10-3-4-11-21(20)29(34)32(27)2)28(33)30-15-18-17-35-24-13-7-8-14-25(24)36-18/h3-14,16,18,26-27H,15,17H2,1-2H3,(H,30,33)