5-[(4-azanyl-1-methyl-piperidin-1-ium-1-yl)methyl]-2-methyl-phenol

Systemtic Name: 5-[(4-azanyl-1-methyl-piperidin-1-ium-1-yl)methyl]-2-methyl-phenol Openeye Name: 5-[(4-amino-1-methyl-piperidin-1-ium-1-yl)methyl]-2-methyl-phenol CAS Name: 5-[(4-amino-1-methyl-1-piperidin-1-iumyl)methyl]-2-methylphenol IUPAC Name: 5-[(4-amino-1-methylpiperidin-1-ium-1-yl)methyl]-2-methylphenol Traditional Name: 5-[(4-amino-1-methyl-piperidin-1-ium-1-yl)methyl]-2-methyl-phenol Formula: C14H23N2O+ MolecularWeight: 235.34522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C[N+]2(CCC(CC2)N)C)O

Isomeric SMILES

CC1=C(C=C(C=C1)C[N+]2(CCC(CC2)N)C)O

InChI

InChI=1S/C14H22N2O/c1-11-3-4-12(9-14(11)17)10-16(2)7-5-13(15)6-8-16/h3-4,9,13H,5-8,10,15H2,1-2H3/p+1