[6-(cyclohexylamino)pyridin-1-ium-3-yl]-[(3S)-3-(methoxymethyl)piperidin-1-yl]methanone

Systemtic Name: [6-(cyclohexylamino)pyridin-1-ium-3-yl]-[(3S)-3-(methoxymethyl)piperidin-1-yl]methanone Openeye Name: [6-(cyclohexylamino)pyridin-1-ium-3-yl]-[(3S)-3-(methoxymethyl)-1-piperidyl]methanone CAS Name: [6-(cyclohexylamino)-3-pyridin-1-iumyl]-[(3S)-3-(methoxymethyl)-1-piperidinyl]methanone IUPAC Name: [6-(cyclohexylamino)pyridin-1-ium-3-yl]-[(3S)-3-(methoxymethyl)piperidin-1-yl]methanone Traditional Name: [6-(cyclohexylamino)pyridin-1-ium-3-yl]-[(3S)-3-(methoxymethyl)piperidino]methanone Formula: C19H30N3O2+ MolecularWeight: 332.4604

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CCCN(C1)C(=O)C2=C[NH+]=C(C=C2)NC3CCCCC3

Isomeric SMILES

COC[C@H]1CCCN(C1)C(=O)C2=C[NH+]=C(C=C2)NC3CCCCC3

InChI

InChI=1S/C19H29N3O2/c1-24-14-15-6-5-11-22(13-15)19(23)16-9-10-18(20-12-16)21-17-7-3-2-4-8-17/h9-10,12,15,17H,2-8,11,13-14H2,1H3,(H,20,21)/p+1/t15-/m0/s1