N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-5-(4-ethanoylphenyl)furan-2-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-5-(4-ethanoylphenyl)furan-2-carboxamide Openeye Name: 5-(4-acetylphenyl)-N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]furan-2-carboxamide CAS Name: 5-(4-acetylphenyl)-N-[2-[(1,3-benzodioxol-5-ylamino)-oxomethyl]phenyl]-2-furancarboxamide IUPAC Name: 5-(4-acetylphenyl)-N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]furan-2-carboxamide Traditional Name: 5-(4-acetylphenyl)-N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-2-furamide Formula: C27H20N2O6 MolecularWeight: 468.4575

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C(=O)NC3=CC=CC=C3C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C(=O)NC3=CC=CC=C3C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H20N2O6/c1-16(30)17-6-8-18(9-7-17)22-12-13-24(35-22)27(32)29-21-5-3-2-4-20(21)26(31)28-19-10-11-23-25(14-19)34-15-33-23/h2-14H,15H2,1H3,(H,28,31)(H,29,32)