cycloheptyl-[[3-(hydroxymethyl)-2,4,6-trimethyl-phenyl]methyl]azanium

Systemtic Name: cycloheptyl-[[3-(hydroxymethyl)-2,4,6-trimethyl-phenyl]methyl]azanium Openeye Name: cycloheptyl-[[3-(hydroxymethyl)-2,4,6-trimethyl-phenyl]methyl]ammonium CAS Name: cycloheptyl-[[3-(hydroxymethyl)-2,4,6-trimethylphenyl]methyl]ammonium IUPAC Name: cycloheptyl-[[3-(hydroxymethyl)-2,4,6-trimethylphenyl]methyl]azanium Traditional Name: cycloheptyl-(2,4,6-trimethyl-3-methylol-benzyl)ammonium Formula: C18H30NO+ MolecularWeight: 276.4369

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C[NH2+]C2CCCCCC2)C)CO)C

Isomeric SMILES

CC1=CC(=C(C(=C1C[NH2+]C2CCCCCC2)C)CO)C

InChI

InChI=1S/C18H29NO/c1-13-10-14(2)18(12-20)15(3)17(13)11-19-16-8-6-4-5-7-9-16/h10,16,19-20H,4-9,11-12H2,1-3H3/p+1