[3-oxidanylidene-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] 4-methylbenzoate

Systemtic Name: [3-oxidanylidene-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] 4-methylbenzoate Openeye Name: [3-oxo-2-(3-pyridylmethylene)benzofuran-6-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [3-oxo-2-(3-pyridinylmethylidene)-6-benzofuranyl] ester IUPAC Name: [3-oxo-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [3-keto-2-(3-pyridylmethylene)coumaran-6-yl] ester Formula: C22H15NO4 MolecularWeight: 357.3588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CN=CC=C4)O3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CN=CC=C4)O3

InChI

InChI=1S/C22H15NO4/c1-14-4-6-16(7-5-14)22(25)26-17-8-9-18-19(12-17)27-20(21(18)24)11-15-3-2-10-23-13-15/h2-13H,1H3