1-adamantyl-[(2S)-3-(1-adamantylcarbonyloxy)-2-oxidanyl-propyl]azanium

Systemtic Name: 1-adamantyl-[(2S)-3-(1-adamantylcarbonyloxy)-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-3-(adamantane-1-carbonyloxy)-2-hydroxy-propyl]-(1-adamantyl)ammonium CAS Name: 1-adamantyl-[(2S)-3-[1-adamantyl(oxo)methoxy]-2-hydroxypropyl]ammonium IUPAC Name: [(2S)-3-(adamantane-1-carbonyloxy)-2-hydroxypropyl]-(1-adamantyl)azanium Traditional Name: [(2S)-3-(adamantane-1-carbonyloxy)-2-hydroxy-propyl]-(1-adamantyl)ammonium Formula: C24H38NO3+ MolecularWeight: 388.56342

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)OCC(C[NH2+]C45CC6CC(C4)CC(C6)C5)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)OC[C@H](C[NH2+]C45CC6CC(C4)CC(C6)C5)O

InChI

InChI=1S/C24H37NO3/c26-21(13-25-24-10-18-4-19(11-24)6-20(5-18)12-24)14-28-22(27)23-7-15-1-16(8-23)3-17(2-15)9-23/h15-21,25-26H,1-14H2/p+1/t15?,16?,17?,18?,19?,20?,21-,23?,24?/m0/s1