6-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine

Systemtic Name: 6-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine Openeye Name: 6-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine CAS Name: 6-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]-3,4-dihydro-2H-1,4-benzoxazine IUPAC Name: 6-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-3,4-dihydro-2H-1,4-benzoxazine Traditional Name: 6-[[(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+]1CC2=CC3=C(C=C2)OCCN3

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC2=CC3=C(C=C2)OCCN3

InChI

InChI=1S/C15H22N2O/c1-12-4-2-3-8-17(12)11-13-5-6-15-14(10-13)16-7-9-18-15/h5-6,10,12,16H,2-4,7-9,11H2,1H3/p+1/t12-/m0/s1