butyl 4-[[1-(4-chlorophenyl)-5-propan-2-yl-1,2,3-triazol-4-yl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[1-(4-chlorophenyl)-5-propan-2-yl-1,2,3-triazol-4-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[1-(4-chlorophenyl)-5-isopropyl-triazole-4-carbonyl]amino]benzoate CAS Name: 4-[[[1-(4-chlorophenyl)-5-propan-2-yl-4-triazolyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[1-(4-chlorophenyl)-5-propan-2-yltriazole-4-carbonyl]amino]benzoate Traditional Name: 4-[[1-(4-chlorophenyl)-5-isopropyl-triazole-4-carbonyl]amino]benzoic acid butyl ester Formula: C23H25ClN4O3 MolecularWeight: 440.9226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25ClN4O3/c1-4-5-14-31-23(30)16-6-10-18(11-7-16)25-22(29)20-21(15(2)3)28(27-26-20)19-12-8-17(24)9-13-19/h6-13,15H,4-5,14H2,1-3H3,(H,25,29)