N-(1,3-benzodioxol-5-ylmethyl)-8-oxidanylidene-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-8-oxidanylidene-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide Traditional Name: 8-keto-N-piperonyl-5,6,13,13a-tetrahydroisoquinolin[2,1-b]isoquinoline-13-carboxamide Formula: C26H22N2O4 MolecularWeight: 426.46388

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(C(C3=CC=CC=C3C2=O)C(=O)NCC4=CC5=C(C=C4)OCO5)C6=CC=CC=C61

Isomeric SMILES

C1CN2C(C(C3=CC=CC=C3C2=O)C(=O)NCC4=CC5=C(C=C4)OCO5)C6=CC=CC=C61

InChI

InChI=1S/C26H22N2O4/c29-25(27-14-16-9-10-21-22(13-16)32-15-31-21)23-19-7-3-4-8-20(19)26(30)28-12-11-17-5-1-2-6-18(17)24(23)28/h1-10,13,23-24H,11-12,14-15H2,(H,27,29)