[(2S)-3-[[(5S,7R)-3-chloranyl-1-adamantyl]carbonyloxy]-2-oxidanyl-propyl]-diethyl-azanium

Systemtic Name: [(2S)-3-[[(5S,7R)-3-chloranyl-1-adamantyl]carbonyloxy]-2-oxidanyl-propyl]-diethyl-azanium Openeye Name: [(2S)-3-[(5S,7R)-3-chloroadamantane-1-carbonyl]oxy-2-hydroxy-propyl]-diethyl-ammonium CAS Name: [(2S)-3-[[(5S,7R)-3-chloro-1-adamantyl]-oxomethoxy]-2-hydroxypropyl]-diethylammonium IUPAC Name: [(2S)-3-[(5S,7R)-3-chloroadamantane-1-carbonyl]oxy-2-hydroxypropyl]-diethylazanium Traditional Name: [(2S)-3-[(5S,7R)-3-chloroadamantane-1-carbonyl]oxy-2-hydroxy-propyl]-diethyl-ammonium Formula: C18H31ClNO3+ MolecularWeight: 344.89664

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(COC(=O)C12CC3CC(C1)CC(C3)(C2)Cl)O

Isomeric SMILES

CC[NH+](CC)C[C@@H](COC(=O)C12C[C@H]3C[C@@H](C1)CC(C3)(C2)Cl)O

InChI

InChI=1S/C18H30ClNO3/c1-3-20(4-2)10-15(21)11-23-16(22)17-6-13-5-14(7-17)9-18(19,8-13)12-17/h13-15,21H,3-12H2,1-2H3/p+1/t13-,14+,15-,17?,18?/m0/s1