methyl 2-(2-diethylaminoethyl)-5-[(4-methoxycarbonylphenyl)amino]-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 2-(2-diethylaminoethyl)-5-[(4-methoxycarbonylphenyl)amino]-1,2,3-triazole-4-carboxylate Openeye Name: methyl 2-(2-diethylaminoethyl)-5-(4-methoxycarbonylanilino)triazole-4-carboxylate CAS Name: 2-(2-diethylaminoethyl)-5-(4-methoxycarbonylanilino)-4-triazolecarboxylic acid methyl ester IUPAC Name: methyl 2-(2-diethylaminoethyl)-5-(4-methoxycarbonylanilino)triazole-4-carboxylate Traditional Name: 5-(4-carbomethoxyanilino)-2-(2-diethylaminoethyl)triazole-4-carboxylic acid methyl ester Formula: C18H25N5O4 MolecularWeight: 375.4222

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1N=C(C(=N1)NC2=CC=C(C=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCN(CC)CCN1N=C(C(=N1)NC2=CC=C(C=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C18H25N5O4/c1-5-22(6-2)11-12-23-20-15(18(25)27-4)16(21-23)19-14-9-7-13(8-10-14)17(24)26-3/h7-10H,5-6,11-12H2,1-4H3,(H,19,21)