(2S)-2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine

Systemtic Name: (2S)-2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine Openeye Name: (2S)-2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine CAS Name: (2S)-2-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]-3,4-dihydro-2H-1,4-benzoxazine IUPAC Name: (2S)-2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine Traditional Name: (2S)-2-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine Formula: C15H23N2O+ MolecularWeight: 247.35592

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2CNC3=CC=CC=C3O2

Isomeric SMILES

C[C@H]1CCCC[NH+]1C[C@@H]2CNC3=CC=CC=C3O2

InChI

InChI=1S/C15H22N2O/c1-12-6-4-5-9-17(12)11-13-10-16-14-7-2-3-8-15(14)18-13/h2-3,7-8,12-13,16H,4-6,9-11H2,1H3/p+1/t12-,13-/m0/s1