3-[(E)-3-[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one

Systemtic Name: 3-[(E)-3-[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 2-hydroxy-3-[(E)-3-[3-methoxy-4-(2-thienylmethoxy)phenyl]prop-2-enoyl]-6-methyl-pyran-4-one CAS Name: 2-hydroxy-3-[(E)-3-[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]-1-oxoprop-2-enyl]-6-methyl-4-pyranone IUPAC Name: 2-hydroxy-3-[(E)-3-[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]prop-2-enoyl]-6-methylpyran-4-one Traditional Name: 2-hydroxy-3-[(E)-3-[3-methoxy-4-(2-thenyloxy)phenyl]acryloyl]-6-methyl-pyran-4-one Formula: C21H18O6S MolecularWeight: 398.42902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C(=O)C=CC2=CC(=C(C=C2)OCC3=CC=CS3)OC

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(=O)/C=C/C2=CC(=C(C=C2)OCC3=CC=CS3)OC

InChI

InChI=1S/C21H18O6S/c1-13-10-17(23)20(21(24)27-13)16(22)7-5-14-6-8-18(19(11-14)25-2)26-12-15-4-3-9-28-15/h3-11,24H,12H2,1-2H3/b7-5+