N-[[(2R)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methyl]-N,1-dimethyl-piperidin-1-ium-4-amine

Systemtic Name: N-[[(2R)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methyl]-N,1-dimethyl-piperidin-1-ium-4-amine Openeye Name: N-[[(2R)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methyl]-N,1-dimethyl-piperidin-1-ium-4-amine CAS Name: N-[[(2R)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methyl]-N,1-dimethyl-4-piperidin-1-iumamine IUPAC Name: N-[[(2R)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methyl]-N,1-dimethylpiperidin-1-ium-4-amine Traditional Name: [(2R)-3,4-dihydro-2H-1,4-benzoxazin-2-yl]methyl-methyl-(1-methylpiperidin-1-ium-4-yl)amine Formula: C16H26N3O+ MolecularWeight: 276.39714

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)CC2CNC3=CC=CC=C3O2

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C[C@H]2CNC3=CC=CC=C3O2

InChI

InChI=1S/C16H25N3O/c1-18-9-7-13(8-10-18)19(2)12-14-11-17-15-5-3-4-6-16(15)20-14/h3-6,13-14,17H,7-12H2,1-2H3/p+1/t14-/m1/s1