diethyl 1-(4-oxidanylidene-2-phenyl-2,3-dihydrochromen-3-yl)-1,2,3-triazole-4,5-dicarboxylate

Systemtic Name: diethyl 1-(4-oxidanylidene-2-phenyl-2,3-dihydrochromen-3-yl)-1,2,3-triazole-4,5-dicarboxylate Openeye Name: diethyl 1-(4-oxo-2-phenyl-chroman-3-yl)triazole-4,5-dicarboxylate CAS Name: 1-(4-oxo-2-phenyl-3,4-dihydro-2H-1-benzopyran-3-yl)triazole-4,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-(4-oxo-2-phenyl-2,3-dihydrochromen-3-yl)triazole-4,5-dicarboxylate Traditional Name: 1-(4-keto-2-phenyl-chroman-3-yl)triazole-4,5-dicarboxylic acid diethyl ester Formula: C23H21N3O6 MolecularWeight: 435.42934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C2C(OC3=CC=CC=C3C2=O)C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C2C(OC3=CC=CC=C3C2=O)C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C23H21N3O6/c1-3-30-22(28)17-18(23(29)31-4-2)26(25-24-17)19-20(27)15-12-8-9-13-16(15)32-21(19)14-10-6-5-7-11-14/h5-13,19,21H,3-4H2,1-2H3