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

Systemtic Name: 2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-N-(1,3-benzodioxol-5-ylcarbamoyl)ethanamide Openeye Name: 2-[4-(azepane-1-carbonyl)-1-piperidyl]-N-(1,3-benzodioxol-5-ylcarbamoyl)acetamide CAS Name: 2-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-N-[(1,3-benzodioxol-5-ylamino)-oxomethyl]acetamide IUPAC Name: 2-[4-(azepane-1-carbonyl)piperidin-1-yl]-N-(1,3-benzodioxol-5-ylcarbamoyl)acetamide Traditional Name: 2-[4-(azepane-1-carbonyl)piperidino]-N-(1,3-benzodioxol-5-ylcarbamoyl)acetamide Formula: C22H30N4O5 MolecularWeight: 430.4974

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)CC(=O)NC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)CC(=O)NC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H30N4O5/c27-20(24-22(29)23-17-5-6-18-19(13-17)31-15-30-18)14-25-11-7-16(8-12-25)21(28)26-9-3-1-2-4-10-26/h5-6,13,16H,1-4,7-12,14-15H2,(H2,23,24,27,29)