(3-methoxy-4-oxidanyl-phenyl)methyl-[(1S,2R)-2-methylcyclohexyl]azanium

Systemtic Name: (3-methoxy-4-oxidanyl-phenyl)methyl-[(1S,2R)-2-methylcyclohexyl]azanium Openeye Name: (4-hydroxy-3-methoxy-phenyl)methyl-[(1S,2R)-2-methylcyclohexyl]ammonium CAS Name: (4-hydroxy-3-methoxyphenyl)methyl-[(1S,2R)-2-methylcyclohexyl]ammonium IUPAC Name: (4-hydroxy-3-methoxyphenyl)methyl-[(1S,2R)-2-methylcyclohexyl]azanium Traditional Name: [(1S,2R)-2-methylcyclohexyl]-vanillyl-ammonium Formula: C15H24NO2+ MolecularWeight: 250.35656

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1[NH2+]CC2=CC(=C(C=C2)O)OC

Isomeric SMILES

C[C@@H]1CCCC[C@@H]1[NH2+]CC2=CC(=C(C=C2)O)OC

InChI

InChI=1S/C15H23NO2/c1-11-5-3-4-6-13(11)16-10-12-7-8-14(17)15(9-12)18-2/h7-9,11,13,16-17H,3-6,10H2,1-2H3/p+1/t11-,13+/m1/s1