methyl 3-[(1-phenyl-5-propyl-1,2,3-triazol-4-yl)carbonylamino]benzoate

Systemtic Name: methyl 3-[(1-phenyl-5-propyl-1,2,3-triazol-4-yl)carbonylamino]benzoate Openeye Name: methyl 3-[(1-phenyl-5-propyl-triazole-4-carbonyl)amino]benzoate CAS Name: 3-[[oxo-(1-phenyl-5-propyl-4-triazolyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(1-phenyl-5-propyltriazole-4-carbonyl)amino]benzoate Traditional Name: 3-[(1-phenyl-5-propyl-triazole-4-carbonyl)amino]benzoic acid methyl ester Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=NN1C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CCCC1=C(N=NN1C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C(=O)OC

InChI

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