1-adamantyl-[(5-methoxy-2-oxidanyl-phenyl)methyl]azanium

Systemtic Name: 1-adamantyl-[(5-methoxy-2-oxidanyl-phenyl)methyl]azanium Openeye Name: 1-adamantyl-[(2-hydroxy-5-methoxy-phenyl)methyl]ammonium CAS Name: 1-adamantyl-[(2-hydroxy-5-methoxyphenyl)methyl]ammonium IUPAC Name: 1-adamantyl-[(2-hydroxy-5-methoxyphenyl)methyl]azanium Traditional Name: 1-adamantyl-(2-hydroxy-5-methoxy-benzyl)ammonium Formula: C18H26NO2+ MolecularWeight: 288.40454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)C[NH2+]C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=CC(=C(C=C1)O)C[NH2+]C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H25NO2/c1-21-16-2-3-17(20)15(7-16)11-19-18-8-12-4-13(9-18)6-14(5-12)10-18/h2-3,7,12-14,19-20H,4-6,8-11H2,1H3/p+1