2-[(E)-2-(3-ethoxy-4-methoxy-phenyl)ethenyl]-5-ethylsulfonyl-1,3-benzoxazole

Systemtic Name: 2-[(E)-2-(3-ethoxy-4-methoxy-phenyl)ethenyl]-5-ethylsulfonyl-1,3-benzoxazole Openeye Name: 2-[(E)-2-(3-ethoxy-4-methoxy-phenyl)vinyl]-5-ethylsulfonyl-1,3-benzoxazole CAS Name: 2-[(E)-2-(3-ethoxy-4-methoxyphenyl)ethenyl]-5-ethylsulfonyl-1,3-benzoxazole IUPAC Name: 2-[(E)-2-(3-ethoxy-4-methoxyphenyl)ethenyl]-5-ethylsulfonyl-1,3-benzoxazole Traditional Name: 5-esyl-2-[(E)-2-(3-ethoxy-4-methoxy-phenyl)vinyl]-1,3-benzoxazole Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC2=NC3=C(O2)C=CC(=C3)S(=O)(=O)CC)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C2=NC3=C(O2)C=CC(=C3)S(=O)(=O)CC)OC

InChI

InChI=1S/C20H21NO5S/c1-4-25-19-12-14(6-9-18(19)24-3)7-11-20-21-16-13-15(27(22,23)5-2)8-10-17(16)26-20/h6-13H,4-5H2,1-3H3/b11-7+