2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-N-(1,3-benzodioxol-5-ylmethyl)ethanamide

Systemtic Name: 2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-N-(1,3-benzodioxol-5-ylmethyl)ethanamide Openeye Name: 2-[4-(azepane-1-carbonyl)-1-piperidyl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide CAS Name: 2-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide IUPAC Name: 2-[4-(azepane-1-carbonyl)piperidin-1-yl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide Traditional Name: 2-[4-(azepane-1-carbonyl)piperidino]-N-piperonyl-acetamide Formula: C22H31N3O4 MolecularWeight: 401.49924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)CC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)CC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H31N3O4/c26-21(23-14-17-5-6-19-20(13-17)29-16-28-19)15-24-11-7-18(8-12-24)22(27)25-9-3-1-2-4-10-25/h5-6,13,18H,1-4,7-12,14-16H2,(H,23,26)