[(2Z)-4-methyl-3-oxidanylidene-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] ethanoate

Systemtic Name: [(2Z)-4-methyl-3-oxidanylidene-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] ethanoate Openeye Name: [(2Z)-4-methyl-3-oxo-2-(3-pyridylmethylene)benzofuran-6-yl] acetate CAS Name: acetic acid [(2Z)-4-methyl-3-oxo-2-(3-pyridinylmethylidene)-6-benzofuranyl] ester IUPAC Name: [(2Z)-4-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] acetate Traditional Name: acetic acid [(2Z)-3-keto-4-methyl-2-(3-pyridylmethylene)coumaran-6-yl] ester Formula: C17H13NO4 MolecularWeight: 295.28942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C(=O)C(=CC3=CN=CC=C3)O2)OC(=O)C

Isomeric SMILES

CC1=CC(=CC2=C1C(=O)/C(=C/C3=CN=CC=C3)/O2)OC(=O)C

InChI

InChI=1S/C17H13NO4/c1-10-6-13(21-11(2)19)8-14-16(10)17(20)15(22-14)7-12-4-3-5-18-9-12/h3-9H,1-2H3/b15-7-