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

Systemtic Name: [1-[(3S)-1-cyclopentylpiperidin-1-ium-3-yl]-1,2,3-triazol-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-[(3S)-1-cyclopentylpiperidin-1-ium-3-yl]triazol-4-yl]-(1-piperidyl)methanone CAS Name: [1-[(3S)-1-cyclopentyl-3-piperidin-1-iumyl]-4-triazolyl]-(1-piperidinyl)methanone IUPAC Name: [1-[(3S)-1-cyclopentylpiperidin-1-ium-3-yl]triazol-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-[(3S)-1-cyclopentylpiperidin-1-ium-3-yl]triazol-4-yl]-piperidino-methanone Formula: C18H30N5O+ MolecularWeight: 332.4637

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CN(N=N2)C3CCC[NH+](C3)C4CCCC4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CN(N=N2)[C@H]3CCC[NH+](C3)C4CCCC4

InChI

InChI=1S/C18H29N5O/c24-18(21-10-4-1-5-11-21)17-14-23(20-19-17)16-9-6-12-22(13-16)15-7-2-3-8-15/h14-16H,1-13H2/p+1/t16-/m0/s1