(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethanamine

Systemtic Name: (1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethanamine Openeye Name: (1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethanamine CAS Name: (1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methyl-1-piperidin-1-iumyl)ethanamine IUPAC Name: (1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethanamine Traditional Name: [(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]amine Formula: C17H27N2O2+ MolecularWeight: 291.40848

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(C2=CC3=C(C=C2)OCCCO3)N

Isomeric SMILES

CC1CC[NH+](CC1)C[C@@H](C2=CC3=C(C=C2)OCCCO3)N

InChI

InChI=1S/C17H26N2O2/c1-13-5-7-19(8-6-13)12-15(18)14-3-4-16-17(11-14)21-10-2-9-20-16/h3-4,11,13,15H,2,5-10,12,18H2,1H3/p+1/t15-/m0/s1