1-adamantyl-[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-[[(1S)-1-methylpropyl]amino]-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-[[(2S)-butan-2-yl]amino]-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-[[(2S)-butan-2-yl]amino]-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-keto-2-[[(1S)-1-methylpropyl]amino]ethyl]ammonium Formula: C16H29N2O+ MolecularWeight: 265.41426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N2O/c1-3-11(2)18-15(19)10-17-16-7-12-4-13(8-16)6-14(5-12)9-16/h11-14,17H,3-10H2,1-2H3,(H,18,19)/p+1/t11-,12?,13?,14?,16?/m0/s1