[(2S)-2-(1-adamantyl)-2-oxidanyl-ethyl]-(phenylmethyl)azanium

Systemtic Name: [(2S)-2-(1-adamantyl)-2-oxidanyl-ethyl]-(phenylmethyl)azanium Openeye Name: [(2S)-2-(1-adamantyl)-2-hydroxy-ethyl]-benzyl-ammonium CAS Name: [(2S)-2-(1-adamantyl)-2-hydroxyethyl]-(phenylmethyl)ammonium IUPAC Name: [(2S)-2-(1-adamantyl)-2-hydroxyethyl]-benzylazanium Traditional Name: [(2S)-2-(1-adamantyl)-2-hydroxy-ethyl]-benzyl-ammonium Formula: C19H28NO+ MolecularWeight: 286.43172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27NO/c21-18(13-20-12-14-4-2-1-3-5-14)19-9-15-6-16(10-19)8-17(7-15)11-19/h1-5,15-18,20-21H,6-13H2/p+1/t15?,16?,17?,18-,19?/m1/s1