pyridin-3-yl (4E)-3-methyl-4-(phenylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: pyridin-3-yl (4E)-3-methyl-4-(phenylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: 3-pyridyl (4E)-3-methyl-4-(phenylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-(phenylhydrazinylidene)-6,7-dihydro-5H-benzofuran-2-carboxylic acid 3-pyridinyl ester IUPAC Name: pyridin-3-yl (4E)-3-methyl-4-(phenylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-3-methyl-4-(phenylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylic acid 3-pyridyl ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC3=CC=CC=C3)CCC2)C(=O)OC4=CN=CC=C4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC3=CC=CC=C3)/CCC2)C(=O)OC4=CN=CC=C4

InChI

InChI=1S/C21H19N3O3/c1-14-19-17(24-23-15-7-3-2-4-8-15)10-5-11-18(19)27-20(14)21(25)26-16-9-6-12-22-13-16/h2-4,6-9,12-13,23H,5,10-11H2,1H3/b24-17+