2-[2-(azepan-1-ylmethyl)-5-methoxy-4-oxidanylidene-pyridin-1-yl]-N-(1,3-benzodioxol-5-ylmethyl)ethanamide

Systemtic Name: 2-[2-(azepan-1-ylmethyl)-5-methoxy-4-oxidanylidene-pyridin-1-yl]-N-(1,3-benzodioxol-5-ylmethyl)ethanamide Openeye Name: 2-[2-(azepan-1-ylmethyl)-5-methoxy-4-oxo-1-pyridyl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide CAS Name: 2-[2-(1-azepanylmethyl)-5-methoxy-4-oxo-1-pyridinyl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide IUPAC Name: 2-[2-(azepan-1-ylmethyl)-5-methoxy-4-oxopyridin-1-yl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide Traditional Name: 2-[2-(azepan-1-ylmethyl)-4-keto-5-methoxy-1-pyridyl]-N-piperonyl-acetamide Formula: C23H29N3O5 MolecularWeight: 427.49346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(C(=CC1=O)CN2CCCCCC2)CC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CN(C(=CC1=O)CN2CCCCCC2)CC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H29N3O5/c1-29-22-14-26(18(11-19(22)27)13-25-8-4-2-3-5-9-25)15-23(28)24-12-17-6-7-20-21(10-17)31-16-30-20/h6-7,10-11,14H,2-5,8-9,12-13,15-16H2,1H3,(H,24,28)