methyl-(2-phenoxyethyl)-[(1-piperidin-1-ium-4-yl-1,2,3-triazol-4-yl)methyl]azanium

Systemtic Name: methyl-(2-phenoxyethyl)-[(1-piperidin-1-ium-4-yl-1,2,3-triazol-4-yl)methyl]azanium Openeye Name: methyl-(2-phenoxyethyl)-[(1-piperidin-1-ium-4-yltriazol-4-yl)methyl]ammonium CAS Name: methyl-(2-phenoxyethyl)-[[1-(4-piperidin-1-iumyl)-4-triazolyl]methyl]ammonium IUPAC Name: methyl-(2-phenoxyethyl)-[(1-piperidin-1-ium-4-yltriazol-4-yl)methyl]azanium Traditional Name: methyl-(2-phenoxyethyl)-[(1-piperidin-1-ium-4-yltriazol-4-yl)methyl]ammonium Formula: C17H27N5O+2 MolecularWeight: 317.42918

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC1=CC=CC=C1)CC2=CN(N=N2)C3CC[NH2+]CC3

Isomeric SMILES

C[NH+](CCOC1=CC=CC=C1)CC2=CN(N=N2)C3CC[NH2+]CC3

InChI

InChI=1S/C17H25N5O/c1-21(11-12-23-17-5-3-2-4-6-17)13-15-14-22(20-19-15)16-7-9-18-10-8-16/h2-6,14,16,18H,7-13H2,1H3/p+2