[3-azaniumyl-2-(4-hydroxyphenyl)-2-methyl-oxan-3-yl]methylazanium

Systemtic Name: [3-azaniumyl-2-(4-hydroxyphenyl)-2-methyl-oxan-3-yl]methylazanium Openeye Name: [3-azaniumyl-2-(4-hydroxyphenyl)-2-methyl-tetrahydropyran-3-yl]methylammonium CAS Name: [3-ammonio-2-(4-hydroxyphenyl)-2-methyl-3-oxanyl]methylammonium IUPAC Name: [3-azaniumyl-2-(4-hydroxyphenyl)-2-methyloxan-3-yl]methylazanium Traditional Name: [3-ammonio-2-(4-hydroxyphenyl)-2-methyl-tetrahydropyran-3-yl]methylammonium Formula: C13H22N2O2+2 MolecularWeight: 238.32598

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCCO1)(C[NH3+])[NH3+])C2=CC=C(C=C2)O

Isomeric SMILES

CC1(C(CCCO1)(C[NH3+])[NH3+])C2=CC=C(C=C2)O

InChI

InChI=1S/C13H20N2O2/c1-12(10-3-5-11(16)6-4-10)13(15,9-14)7-2-8-17-12/h3-6,16H,2,7-9,14-15H2,1H3/p+2