ethyl 4-[(phenylmethyl)amino]-4H-1,2,3-triazole-5-carboxylate

Systemtic Name: ethyl 4-[(phenylmethyl)amino]-4H-1,2,3-triazole-5-carboxylate Openeye Name: ethyl 4-(benzylamino)-4H-triazole-5-carboxylate CAS Name: 4-[(phenylmethyl)amino]-4H-triazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(benzylamino)-4H-triazole-5-carboxylate Traditional Name: 4-(benzylamino)-4H-triazole-5-carboxylic acid ethyl ester Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN=NC1NCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=NN=NC1NCC2=CC=CC=C2

InChI

InChI=1S/C12H14N4O2/c1-2-18-12(17)10-11(15-16-14-10)13-8-9-6-4-3-5-7-9/h3-7,11,13H,2,8H2,1H3