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

Systemtic Name: N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methoxy-phenyl]-3-(2-oxidanylidenechromen-3-yl)benzamide Openeye Name: N-[5-[5-(hydroxymethyl)-2-furyl]-2-methoxy-phenyl]-3-(2-oxochromen-3-yl)benzamide CAS Name: N-[5-[5-(hydroxymethyl)-2-furanyl]-2-methoxyphenyl]-3-(2-oxo-1-benzopyran-3-yl)benzamide IUPAC Name: N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methoxyphenyl]-3-(2-oxochromen-3-yl)benzamide Traditional Name: 3-(2-ketochromen-3-yl)-N-[2-methoxy-5-(5-methylol-2-furyl)phenyl]benzamide Formula: C28H21NO6 MolecularWeight: 467.46944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC=C(O2)CO)NC(=O)C3=CC=CC(=C3)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC=C(O2)CO)NC(=O)C3=CC=CC(=C3)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C28H21NO6/c1-33-26-11-9-19(25-12-10-21(16-30)34-25)15-23(26)29-27(31)20-7-4-6-17(13-20)22-14-18-5-2-3-8-24(18)35-28(22)32/h2-15,30H,16H2,1H3,(H,29,31)