1-adamantyl-[2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-[[(1R)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-[[(1R)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-keto-ethyl]ammonium Formula: C18H28N3O+ MolecularWeight: 302.43442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NC(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[C@](C#N)(C1CC1)NC(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H27N3O/c1-17(11-19,15-2-3-15)21-16(22)10-20-18-7-12-4-13(8-18)6-14(5-12)9-18/h12-15,20H,2-10H2,1H3,(H,21,22)/p+1/t12?,13?,14?,17-,18?/m0/s1