N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxo-propyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[3-keto-3-(piperonylamino)propyl]-3,4,5-trimethoxy-benzamide Formula: C21H24N2O7 MolecularWeight: 416.42446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NCCC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NCCC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H24N2O7/c1-26-17-9-14(10-18(27-2)20(17)28-3)21(25)22-7-6-19(24)23-11-13-4-5-15-16(8-13)30-12-29-15/h4-5,8-10H,6-7,11-12H2,1-3H3,(H,22,25)(H,23,24)