3-(4-methylphenyl)-5-[(4-methylphenyl)carbamoyl]-1-(3-phenylpropyl)-1,2,3-triazol-1-ium-4-olate

Systemtic Name: 3-(4-methylphenyl)-5-[(4-methylphenyl)carbamoyl]-1-(3-phenylpropyl)-1,2,3-triazol-1-ium-4-olate Openeye Name: 1-(3-phenylpropyl)-3-(p-tolyl)-5-(p-tolylcarbamoyl)triazol-1-ium-4-olate CAS Name: 5-[(4-methylanilino)-oxomethyl]-3-(4-methylphenyl)-1-(3-phenylpropyl)-4-triazol-1-iumolate IUPAC Name: 3-(4-methylphenyl)-5-[(4-methylphenyl)carbamoyl]-1-(3-phenylpropyl)triazol-1-ium-4-olate Traditional Name: 1-(3-phenylpropyl)-3-(p-tolyl)-5-(p-tolylcarbamoyl)triazol-1-ium-4-olate Formula: C26H26N4O2 MolecularWeight: 426.51024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(N(N=[N+]2CCCC3=CC=CC=C3)C4=CC=C(C=C4)C)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(N(N=[N+]2CCCC3=CC=CC=C3)C4=CC=C(C=C4)C)[O-]

InChI

InChI=1S/C26H26N4O2/c1-19-10-14-22(15-11-19)27-25(31)24-26(32)30(23-16-12-20(2)13-17-23)28-29(24)18-6-9-21-7-4-3-5-8-21/h3-5,7-8,10-17H,6,9,18H2,1-2H3,(H-,27,28,31,32)