6-[(E)-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[(E)-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[(E)-3-(2-ethylbenzofuran-3-yl)prop-2-enoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[(E)-3-(2-ethyl-3-benzofuranyl)-1-oxoprop-2-enyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[(E)-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[(E)-3-(2-ethylbenzofuran-3-yl)acryloyl]-4H-1,4-benzoxazin-3-one Formula: C21H17NO4 MolecularWeight: 347.36398

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)C=CC(=O)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)/C=C/C(=O)C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C21H17NO4/c1-2-18-15(14-5-3-4-6-19(14)26-18)8-9-17(23)13-7-10-20-16(11-13)22-21(24)12-25-20/h3-11H,2,12H2,1H3,(H,22,24)/b9-8+