methyl 4-[5-[(2-oxidanylidene-5-phenyl-1-pyridin-3-yl-pyrrol-3-ylidene)methyl]furan-2-yl]benzoate

Systemtic Name: methyl 4-[5-[(2-oxidanylidene-5-phenyl-1-pyridin-3-yl-pyrrol-3-ylidene)methyl]furan-2-yl]benzoate Openeye Name: methyl 4-[5-[[2-oxo-5-phenyl-1-(3-pyridyl)pyrrol-3-ylidene]methyl]-2-furyl]benzoate CAS Name: 4-[5-[[2-oxo-5-phenyl-1-(3-pyridinyl)-3-pyrrolylidene]methyl]-2-furanyl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-[(2-oxo-5-phenyl-1-pyridin-3-ylpyrrol-3-ylidene)methyl]furan-2-yl]benzoate Traditional Name: 4-[5-[[2-keto-5-phenyl-1-(3-pyridyl)-2-pyrrolin-3-ylidene]methyl]-2-furyl]benzoic acid methyl ester Formula: C28H20N2O4 MolecularWeight: 448.4694

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C3C=C(N(C3=O)C4=CN=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C3C=C(N(C3=O)C4=CN=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H20N2O4/c1-33-28(32)21-11-9-20(10-12-21)26-14-13-24(34-26)16-22-17-25(19-6-3-2-4-7-19)30(27(22)31)23-8-5-15-29-18-23/h2-18H,1H3