1-adamantyl-[[3,4-bis(oxidanyl)phenyl]methyl]azanium

Systemtic Name: 1-adamantyl-[[3,4-bis(oxidanyl)phenyl]methyl]azanium Openeye Name: 1-adamantyl-[(3,4-dihydroxyphenyl)methyl]ammonium CAS Name: 1-adamantyl-[(3,4-dihydroxyphenyl)methyl]ammonium IUPAC Name: 1-adamantyl-[(3,4-dihydroxyphenyl)methyl]azanium Traditional Name: 1-adamantyl(protocatechuyl)ammonium Formula: C17H24NO2+ MolecularWeight: 274.37796

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=CC(=C(C=C4)O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=CC(=C(C=C4)O)O

InChI

InChI=1S/C17H23NO2/c19-15-2-1-11(6-16(15)20)10-18-17-7-12-3-13(8-17)5-14(4-12)9-17/h1-2,6,12-14,18-20H,3-5,7-10H2/p+1