N-[4-[5-(hydroxymethyl)furan-2-yl]-3-methyl-phenyl]-3-(2-oxidanylidenechromen-3-yl)benzamide

Systemtic Name: N-[4-[5-(hydroxymethyl)furan-2-yl]-3-methyl-phenyl]-3-(2-oxidanylidenechromen-3-yl)benzamide Openeye Name: N-[4-[5-(hydroxymethyl)-2-furyl]-3-methyl-phenyl]-3-(2-oxochromen-3-yl)benzamide CAS Name: N-[4-[5-(hydroxymethyl)-2-furanyl]-3-methylphenyl]-3-(2-oxo-1-benzopyran-3-yl)benzamide IUPAC Name: N-[4-[5-(hydroxymethyl)furan-2-yl]-3-methylphenyl]-3-(2-oxochromen-3-yl)benzamide Traditional Name: 3-(2-ketochromen-3-yl)-N-[3-methyl-4-(5-methylol-2-furyl)phenyl]benzamide Formula: C28H21NO5 MolecularWeight: 451.47004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC=CC(=C2)C3=CC4=CC=CC=C4OC3=O)C5=CC=C(O5)CO

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC=CC(=C2)C3=CC4=CC=CC=C4OC3=O)C5=CC=C(O5)CO

InChI

InChI=1S/C28H21NO5/c1-17-13-21(9-11-23(17)26-12-10-22(16-30)33-26)29-27(31)20-7-4-6-18(14-20)24-15-19-5-2-3-8-25(19)34-28(24)32/h2-15,30H,16H2,1H3,(H,29,31)