5-methoxy-4-[(E)-3-[4-(2-morpholin-4-ylethoxy)phenyl]prop-2-enoyl]-1,3-benzoxathiol-2-one

Systemtic Name: 5-methoxy-4-[(E)-3-[4-(2-morpholin-4-ylethoxy)phenyl]prop-2-enoyl]-1,3-benzoxathiol-2-one Openeye Name: 5-methoxy-4-[(E)-3-[4-(2-morpholinoethoxy)phenyl]prop-2-enoyl]-1,3-benzoxathiol-2-one CAS Name: 5-methoxy-4-[(E)-3-[4-[2-(4-morpholinyl)ethoxy]phenyl]-1-oxoprop-2-enyl]-1,3-benzoxathiol-2-one IUPAC Name: 5-methoxy-4-[(E)-3-[4-(2-morpholin-4-ylethoxy)phenyl]prop-2-enoyl]-1,3-benzoxathiol-2-one Traditional Name: 5-methoxy-4-[(E)-3-[4-(2-morpholinoethoxy)phenyl]acryloyl]-1,3-benzoxathiol-2-one Formula: C23H23NO6S MolecularWeight: 441.49682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)OC(=O)S2)C(=O)C=CC3=CC=C(C=C3)OCCN4CCOCC4

Isomeric SMILES

COC1=C(C2=C(C=C1)OC(=O)S2)C(=O)/C=C/C3=CC=C(C=C3)OCCN4CCOCC4

InChI

InChI=1S/C23H23NO6S/c1-27-19-8-9-20-22(31-23(26)30-20)21(19)18(25)7-4-16-2-5-17(6-3-16)29-15-12-24-10-13-28-14-11-24/h2-9H,10-15H2,1H3/b7-4+