2-[(Z)-2-(4-butoxy-3-ethoxy-phenyl)-1-chloranyl-ethenyl]-3,1-benzoxazin-4-one

Systemtic Name: 2-[(Z)-2-(4-butoxy-3-ethoxy-phenyl)-1-chloranyl-ethenyl]-3,1-benzoxazin-4-one Openeye Name: 2-[(Z)-2-(4-butoxy-3-ethoxy-phenyl)-1-chloro-vinyl]-3,1-benzoxazin-4-one CAS Name: 2-[(Z)-2-(4-butoxy-3-ethoxyphenyl)-1-chloroethenyl]-3,1-benzoxazin-4-one IUPAC Name: 2-[(Z)-2-(4-butoxy-3-ethoxyphenyl)-1-chloroethenyl]-3,1-benzoxazin-4-one Traditional Name: 2-[(Z)-2-(4-butoxy-3-ethoxy-phenyl)-1-chloro-vinyl]-3,1-benzoxazin-4-one Formula: C22H22ClNO4 MolecularWeight: 399.86738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=C(C2=NC3=CC=CC=C3C(=O)O2)Cl)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C(/C2=NC3=CC=CC=C3C(=O)O2)\Cl)OCC

InChI

InChI=1S/C22H22ClNO4/c1-3-5-12-27-19-11-10-15(14-20(19)26-4-2)13-17(23)21-24-18-9-7-6-8-16(18)22(25)28-21/h6-11,13-14H,3-5,12H2,1-2H3/b17-13-