N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-piperidin-1-ium-1-yl-acetamide Formula: C16H23N2O3+ MolecularWeight: 291.36542

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C16H22N2O3/c19-16(12-18-7-2-1-3-8-18)17-13-5-6-14-15(11-13)21-10-4-9-20-14/h5-6,11H,1-4,7-10,12H2,(H,17,19)/p+1