5-azanyl-N-heptyl-1-(4-methoxyphenyl)-2H-1,2,3-triazol-1-ium-4-carboxamide

Systemtic Name: 5-azanyl-N-heptyl-1-(4-methoxyphenyl)-2H-1,2,3-triazol-1-ium-4-carboxamide Openeye Name: 5-amino-N-heptyl-1-(4-methoxyphenyl)-2H-triazol-1-ium-4-carboxamide CAS Name: 5-amino-N-heptyl-1-(4-methoxyphenyl)-2H-triazol-1-ium-4-carboxamide IUPAC Name: 5-amino-N-heptyl-1-(4-methoxyphenyl)-2H-triazol-1-ium-4-carboxamide Traditional Name: 5-amino-N-heptyl-1-(4-methoxyphenyl)-2H-triazol-1-ium-4-carboxamide Formula: C17H26N5O2+ MolecularWeight: 332.42064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)C1=NN[N+](=C1N)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCCCNC(=O)C1=NN[N+](=C1N)C2=CC=C(C=C2)OC

InChI

InChI=1S/C17H25N5O2/c1-3-4-5-6-7-12-19-17(23)15-16(18)22(21-20-15)13-8-10-14(24-2)11-9-13/h8-11H,3-7,12H2,1-2H3,(H3,18,19,21,23)/p+1