[1-[(3S)-1-cyclohexylpiperidin-1-ium-3-yl]-1,2,3-triazol-4-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-[(3S)-1-cyclohexylpiperidin-1-ium-3-yl]-1,2,3-triazol-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-[(3S)-1-cyclohexylpiperidin-1-ium-3-yl]triazol-4-yl]-(1-piperidyl)methanone CAS Name: [1-[(3S)-1-cyclohexyl-3-piperidin-1-iumyl]-4-triazolyl]-(1-piperidinyl)methanone IUPAC Name: [1-[(3S)-1-cyclohexylpiperidin-1-ium-3-yl]triazol-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-[(3S)-1-cyclohexylpiperidin-1-ium-3-yl]triazol-4-yl]-piperidino-methanone Formula: C19H32N5O+ MolecularWeight: 346.49028

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCCC(C2)N3C=C(N=N3)C(=O)N4CCCCC4

Isomeric SMILES

C1CCC(CC1)[NH+]2CCC[C@@H](C2)N3C=C(N=N3)C(=O)N4CCCCC4

InChI

InChI=1S/C19H31N5O/c25-19(22-11-5-2-6-12-22)18-15-24(21-20-18)17-10-7-13-23(14-17)16-8-3-1-4-9-16/h15-17H,1-14H2/p+1/t17-/m0/s1