[(2R)-3-(1-adamantylmethoxy)-2-oxidanyl-propyl]-(2-hydroxyethyl)-(phenylmethyl)azanium

Systemtic Name: [(2R)-3-(1-adamantylmethoxy)-2-oxidanyl-propyl]-(2-hydroxyethyl)-(phenylmethyl)azanium Openeye Name: [(2R)-3-(1-adamantylmethoxy)-2-hydroxy-propyl]-benzyl-(2-hydroxyethyl)ammonium CAS Name: [(2R)-3-(1-adamantylmethoxy)-2-hydroxypropyl]-(2-hydroxyethyl)-(phenylmethyl)ammonium IUPAC Name: [(2R)-3-(1-adamantylmethoxy)-2-hydroxypropyl]-benzyl-(2-hydroxyethyl)azanium Traditional Name: [(2R)-3-(1-adamantylmethoxy)-2-hydroxy-propyl]-benzyl-(2-hydroxyethyl)ammonium Formula: C23H36NO3+ MolecularWeight: 374.53684

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)COCC(C[NH+](CCO)CC4=CC=CC=C4)O

Isomeric SMILES

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

InChI

InChI=1S/C23H35NO3/c25-7-6-24(14-18-4-2-1-3-5-18)15-22(26)16-27-17-23-11-19-8-20(12-23)10-21(9-19)13-23/h1-5,19-22,25-26H,6-17H2/p+1/t19?,20?,21?,22-,23?/m1/s1