6-[(E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[(E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[(E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[(E)-3-(4-butoxy-3-ethoxyphenyl)-1-oxoprop-2-enyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[(E)-3-(4-butoxy-3-ethoxyphenyl)prop-2-enoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[(E)-3-(4-butoxy-3-ethoxy-phenyl)acryloyl]-4H-1,4-benzoxazin-3-one Formula: C23H25NO5 MolecularWeight: 395.4483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=CC(=O)C2=CC3=C(C=C2)OCC(=O)N3)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C/C(=O)C2=CC3=C(C=C2)OCC(=O)N3)OCC

InChI

InChI=1S/C23H25NO5/c1-3-5-12-28-21-10-7-16(13-22(21)27-4-2)6-9-19(25)17-8-11-20-18(14-17)24-23(26)15-29-20/h6-11,13-14H,3-5,12,15H2,1-2H3,(H,24,26)/b9-6+