(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 1,5-diphenyl-1,2,4-triazole-3-carboxylate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 1,5-diphenyl-1,2,4-triazole-3-carboxylate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 1,5-diphenyl-1,2,4-triazole-3-carboxylate CAS Name: 1,5-diphenyl-1,2,4-triazole-3-carboxylic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 1,5-diphenyl-1,2,4-triazole-3-carboxylate Traditional Name: 1,5-diphenyl-1,2,4-triazole-3-carboxylic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C29H19N3O4 MolecularWeight: 473.47886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2C3=CC=CC=C3)C(=O)OCC4=CC(=O)OC5=C4C6=CC=CC=C6C=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2C3=CC=CC=C3)C(=O)OCC4=CC(=O)OC5=C4C6=CC=CC=C6C=C5

InChI

InChI=1S/C29H19N3O4/c33-25-17-21(26-23-14-8-7-9-19(23)15-16-24(26)36-25)18-35-29(34)27-30-28(20-10-3-1-4-11-20)32(31-27)22-12-5-2-6-13-22/h1-17H,18H2