1-adamantyl-[2-[[(2R)-2-cyano-3-methyl-butan-2-yl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-[[(2R)-2-cyano-3-methyl-butan-2-yl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-[[(1R)-1-cyano-1,2-dimethyl-propyl]amino]-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-[[(2R)-2-cyano-3-methylbutan-2-yl]amino]-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-[[(2R)-2-cyano-3-methylbutan-2-yl]amino]-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-[[(1R)-1-cyano-1,2-dimethyl-propyl]amino]-2-keto-ethyl]ammonium Formula: C18H30N3O+ MolecularWeight: 304.4503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)C[NH2+]C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CC(C)[C@](C)(C#N)NC(=O)C[NH2+]C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C18H29N3O/c1-12(2)17(3,11-19)21-16(22)10-20-18-7-13-4-14(8-18)6-15(5-13)9-18/h12-15,20H,4-10H2,1-3H3,(H,21,22)/p+1/t13?,14?,15?,17-,18?/m0/s1