diethyl 1-(8-acetamidonaphthalen-1-yl)-1,2,3-triazole-4,5-dicarboxylate

Systemtic Name: diethyl 1-(8-acetamidonaphthalen-1-yl)-1,2,3-triazole-4,5-dicarboxylate Openeye Name: diethyl 1-(8-acetamido-1-naphthyl)triazole-4,5-dicarboxylate CAS Name: 1-(8-acetamido-1-naphthalenyl)triazole-4,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-(8-acetamidonaphthalen-1-yl)triazole-4,5-dicarboxylate Traditional Name: 1-(8-acetamido-1-naphthyl)triazole-4,5-dicarboxylic acid diethyl ester Formula: C20H20N4O5 MolecularWeight: 396.3966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C2=CC=CC3=C2C(=CC=C3)NC(=O)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C2=CC=CC3=C2C(=CC=C3)NC(=O)C)C(=O)OCC

InChI

InChI=1S/C20H20N4O5/c1-4-28-19(26)17-18(20(27)29-5-2)24(23-22-17)15-11-7-9-13-8-6-10-14(16(13)15)21-12(3)25/h6-11H,4-5H2,1-3H3,(H,21,25)