ethyl 5-[(4-chlorophenyl)amino]-1-(ethylcarbamoyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 5-[(4-chlorophenyl)amino]-1-(ethylcarbamoyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-(4-chloroanilino)-1-(ethylcarbamoyl)triazole-4-carboxylate CAS Name: 5-(4-chloroanilino)-1-(ethylcarbamoyl)-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chloroanilino)-1-(ethylcarbamoyl)triazole-4-carboxylate Traditional Name: 5-(4-chloroanilino)-1-(ethylcarbamoyl)triazole-4-carboxylic acid ethyl ester Formula: C14H16ClN5O3 MolecularWeight: 337.76154

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1C(=C(N=N1)C(=O)OCC)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CCNC(=O)N1C(=C(N=N1)C(=O)OCC)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H16ClN5O3/c1-3-16-14(22)20-12(11(18-19-20)13(21)23-4-2)17-10-7-5-9(15)6-8-10/h5-8,17H,3-4H2,1-2H3,(H,16,22)