5-[4-[(E)-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enoyl]phenyl]furan-2-carboxylate

Systemtic Name: 5-[4-[(E)-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enoyl]phenyl]furan-2-carboxylate Openeye Name: 5-[4-[(E)-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enoyl]phenyl]furan-2-carboxylate CAS Name: 5-[4-[(E)-3-(7-methoxy-1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]phenyl]-2-furancarboxylate IUPAC Name: 5-[4-[(E)-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enoyl]phenyl]furan-2-carboxylate Traditional Name: 5-[4-[(E)-3-(7-methoxy-1,3-benzodioxol-5-yl)acryloyl]phenyl]-2-furoate Formula: C22H15O7- MolecularWeight: 391.3503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C=CC(=O)C3=CC=C(C=C3)C4=CC=C(O4)C(=O)[O-]

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)/C=C/C(=O)C3=CC=C(C=C3)C4=CC=C(O4)C(=O)[O-]

InChI

InChI=1S/C22H16O7/c1-26-19-10-13(11-20-21(19)28-12-27-20)2-7-16(23)14-3-5-15(6-4-14)17-8-9-18(29-17)22(24)25/h2-11H,12H2,1H3,(H,24,25)/p-1/b7-2+