dimethyl 1-naphthalen-1-yl-1,2,3-triazole-4,5-dicarboxylate

Systemtic Name: dimethyl 1-naphthalen-1-yl-1,2,3-triazole-4,5-dicarboxylate Openeye Name: dimethyl 1-(1-naphthyl)triazole-4,5-dicarboxylate CAS Name: 1-(1-naphthalenyl)triazole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-naphthalen-1-yltriazole-4,5-dicarboxylate Traditional Name: 1-(1-naphthyl)triazole-4,5-dicarboxylic acid dimethyl ester Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=N1)C2=CC=CC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(N(N=N1)C2=CC=CC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C16H13N3O4/c1-22-15(20)13-14(16(21)23-2)19(18-17-13)12-9-5-7-10-6-3-4-8-11(10)12/h3-9H,1-2H3