(2R)-2-azaniumyl-2-[3-[(1R)-1-azaniumyl-2-oxidanidyl-2-oxidanylidene-ethyl]-1-adamantyl]ethanoate

Systemtic Name: (2R)-2-azaniumyl-2-[3-[(1R)-1-azaniumyl-2-oxidanidyl-2-oxidanylidene-ethyl]-1-adamantyl]ethanoate Openeye Name: (2R)-2-azaniumyl-2-[3-[(1R)-1-azaniumyl-2-oxido-2-oxo-ethyl]-1-adamantyl]acetate CAS Name: (2R)-2-ammonio-2-[3-[(1R)-1-ammonio-2-oxido-2-oxoethyl]-1-adamantyl]acetate IUPAC Name: (2R)-2-azaniumyl-2-[3-[(1R)-1-azaniumyl-2-oxido-2-oxoethyl]-1-adamantyl]acetate Traditional Name: (2R)-2-ammonio-2-[3-[(1R)-1-ammonio-2-keto-2-oxido-ethyl]-1-adamantyl]acetate Formula: C14H22N2O4 MolecularWeight: 282.33548

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)C(C(=O)[O-])[NH3+])C(C(=O)[O-])[NH3+]

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)[C@H](C(=O)[O-])[NH3+])[C@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C14H22N2O4/c15-9(11(17)18)13-2-7-1-8(4-13)5-14(3-7,6-13)10(16)12(19)20/h7-10H,1-6,15-16H2,(H,17,18)(H,19,20)/t7?,8?,9-,10-,13?,14?/m0/s1