[1-(cyclohexylmethyl)-1,2,3-triazol-4-yl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: [1-(cyclohexylmethyl)-1,2,3-triazol-4-yl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: [1-(cyclohexylmethyl)triazol-4-yl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: [1-(cyclohexylmethyl)-4-triazolyl]-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: [1-(cyclohexylmethyl)triazol-4-yl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: [1-(cyclohexylmethyl)triazol-4-yl]-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C19H27N6O+ MolecularWeight: 355.45728

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C=C(N=N2)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

C1CCC(CC1)CN2C=C(N=N2)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C19H26N6O/c26-19(17-15-25(22-21-17)14-16-6-2-1-3-7-16)24-12-10-23(11-13-24)18-8-4-5-9-20-18/h4-5,8-9,15-16H,1-3,6-7,10-14H2/p+1