[(3R,5S)-3,5-dimethyl-1-adamantyl]-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [(3R,5S)-3,5-dimethyl-1-adamantyl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: [(3R,5S)-3,5-dimethyl-1-adamantyl]-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: [(3R,5S)-3,5-dimethyl-1-adamantyl]-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: [(3R,5S)-3,5-dimethyl-1-adamantyl]-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: [(3R,5S)-3,5-dimethyl-1-adamantyl]-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C19H33N2O+ MolecularWeight: 305.47812

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C23CC4CC(C2)(CC(C4)(C3)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C23CC4C[C@@](C2)(C[C@](C4)(C3)C)C

InChI

InChI=1S/C19H32N2O/c1-4-20-5-7-21(8-6-20)16(22)19-11-15-9-17(2,13-19)12-18(3,10-15)14-19/h15H,4-14H2,1-3H3/p+1/t15?,17-,18+,19?