1-(4-acetyloxybutyl)-3-(4-methoxyphenyl)-5-[(4-methoxyphenyl)carbamoyl]-1,2,3-triazol-1-ium-4-olate

Systemtic Name: 1-(4-acetyloxybutyl)-3-(4-methoxyphenyl)-5-[(4-methoxyphenyl)carbamoyl]-1,2,3-triazol-1-ium-4-olate Openeye Name: 1-(4-acetoxybutyl)-3-(4-methoxyphenyl)-5-[(4-methoxyphenyl)carbamoyl]triazol-1-ium-4-olate CAS Name: 1-(4-acetyloxybutyl)-5-[(4-methoxyanilino)-oxomethyl]-3-(4-methoxyphenyl)-4-triazol-1-iumolate IUPAC Name: 1-(4-acetyloxybutyl)-3-(4-methoxyphenyl)-5-[(4-methoxyphenyl)carbamoyl]triazol-1-ium-4-olate Traditional Name: 1-(4-acetoxybutyl)-3-(4-methoxyphenyl)-5-[(4-methoxyphenyl)carbamoyl]triazol-1-ium-4-olate Formula: C23H26N4O6 MolecularWeight: 454.47574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCC[N+]1=NN(C(=C1C(=O)NC2=CC=C(C=C2)OC)[O-])C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)OCCCC[N+]1=NN(C(=C1C(=O)NC2=CC=C(C=C2)OC)[O-])C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H26N4O6/c1-16(28)33-15-5-4-14-26-21(22(29)24-17-6-10-19(31-2)11-7-17)23(30)27(25-26)18-8-12-20(32-3)13-9-18/h6-13H,4-5,14-15H2,1-3H3,(H-,24,25,29,30)