N-(1,3-benzodioxol-5-ylmethyl)-2-ethyl-6,7-dimethoxy-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-ethyl-6,7-dimethoxy-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-ethyl-6,7-dimethoxy-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-ethyl-6,7-dimethoxy-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-ethyl-6,7-dimethoxy-1-oxoisoquinoline-4-carboxamide Traditional Name: 2-ethyl-1-keto-6,7-dimethoxy-N-piperonyl-isoquinoline-4-carboxamide Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H22N2O6/c1-4-24-11-16(14-8-18(27-2)19(28-3)9-15(14)22(24)26)21(25)23-10-13-5-6-17-20(7-13)30-12-29-17/h5-9,11H,4,10,12H2,1-3H3,(H,23,25)