[4-(2-methoxyethyl)piperazin-4-ium-1-yl]-(1-phenethyl-1,2,3-triazol-4-yl)methanone

Systemtic Name: [4-(2-methoxyethyl)piperazin-4-ium-1-yl]-(1-phenethyl-1,2,3-triazol-4-yl)methanone Openeye Name: [4-(2-methoxyethyl)piperazin-4-ium-1-yl]-(1-phenethyltriazol-4-yl)methanone CAS Name: [4-(2-methoxyethyl)-1-piperazin-4-iumyl]-(1-phenethyl-4-triazolyl)methanone IUPAC Name: [4-(2-methoxyethyl)piperazin-4-ium-1-yl]-(1-phenethyltriazol-4-yl)methanone Traditional Name: [4-(2-methoxyethyl)piperazin-4-ium-1-yl]-(1-phenethyltriazol-4-yl)methanone Formula: C18H26N5O2+ MolecularWeight: 344.43134

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+]1CCN(CC1)C(=O)C2=CN(N=N2)CCC3=CC=CC=C3

Isomeric SMILES

COCC[NH+]1CCN(CC1)C(=O)C2=CN(N=N2)CCC3=CC=CC=C3

InChI

InChI=1S/C18H25N5O2/c1-25-14-13-21-9-11-22(12-10-21)18(24)17-15-23(20-19-17)8-7-16-5-3-2-4-6-16/h2-6,15H,7-14H2,1H3/p+1