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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)C(=O)N4CCC[NH+](CC4)C)C

Isomeric SMILES

C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)C(=O)N4CCC[NH+](CC4)C)C

InChI

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