(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 5-methyl-2-phenyl-triazole-4-carboxylate CAS Name: 5-methyl-2-phenyl-4-triazolecarboxylic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 5-methyl-2-phenyltriazole-4-carboxylate Traditional Name: 5-methyl-2-phenyl-triazole-4-carboxylic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C21H17N3O5 MolecularWeight: 391.37678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(N=C1C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O5/c1-13-20(23-24(22-13)15-6-4-3-5-7-15)21(26)28-12-14-10-19(25)29-18-11-16(27-2)8-9-17(14)18/h3-11H,12H2,1-2H3