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(3S)-1-(2-adamantyl)-3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-ium

(3S)-1-(2-adamantyl)-3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-ium

Systemtic Name:(3S)-1-(2-adamantyl)-3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-ium
Openeye Name:(3S)-1-(2-adamantyl)-3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-ium
CAS Name:(3S)-1-(2-adamantyl)-3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-ium
IUPAC Name:(3S)-1-(2-adamantyl)-3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-ium
Traditional Name:(3S)-1-(2-adamantyl)-3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-ium
Formula: C19H30N3+
MolecularWeight: 300.4616
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NN=C1)C2CCC[NH+](C2)C3C4CC5CC(C4)CC3C5


Isomeric SMILES

CC1=C(NN=C1)[C@H]2CCC[NH+](C2)C3C4CC5CC(C4)CC3C5


InChI

InChI=1S/C19H29N3/c1-12-10-20-21-18(12)15-3-2-4-22(11-15)19-16-6-13-5-14(8-16)9-17(19)7-13/h10,13-17,19H,2-9,11H2,1H3,(H,20,21)/p+1/t13?,14?,15-,16?,17?,19?/m0/s1


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