butyl 4-[(1-phenyl-1,2,3-triazol-4-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(1-phenyl-1,2,3-triazol-4-yl)carbonylamino]benzoate Openeye Name: butyl 4-[(1-phenyltriazole-4-carbonyl)amino]benzoate CAS Name: 4-[[oxo-(1-phenyl-4-triazolyl)methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(1-phenyltriazole-4-carbonyl)amino]benzoate Traditional Name: 4-[(1-phenyltriazole-4-carbonyl)amino]benzoic acid butyl ester Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(N=N2)C3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C20H20N4O3/c1-2-3-13-27-20(26)15-9-11-16(12-10-15)21-19(25)18-14-24(23-22-18)17-7-5-4-6-8-17/h4-12,14H,2-3,13H2,1H3,(H,21,25)