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

Systemtic Name: 2-[(Z)-1-chloranyl-2-(3-ethoxy-4-propoxy-phenyl)ethenyl]-3,1-benzoxazin-4-one Openeye Name: 2-[(Z)-1-chloro-2-(3-ethoxy-4-propoxy-phenyl)vinyl]-3,1-benzoxazin-4-one CAS Name: 2-[(Z)-1-chloro-2-(3-ethoxy-4-propoxyphenyl)ethenyl]-3,1-benzoxazin-4-one IUPAC Name: 2-[(Z)-1-chloro-2-(3-ethoxy-4-propoxyphenyl)ethenyl]-3,1-benzoxazin-4-one Traditional Name: 2-[(Z)-1-chloro-2-(3-ethoxy-4-propoxy-phenyl)vinyl]-3,1-benzoxazin-4-one Formula: C21H20ClNO4 MolecularWeight: 385.8408

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=C(C2=NC3=CC=CC=C3C(=O)O2)Cl)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C(/C2=NC3=CC=CC=C3C(=O)O2)\Cl)OCC

InChI

InChI=1S/C21H20ClNO4/c1-3-11-26-18-10-9-14(13-19(18)25-4-2)12-16(22)20-23-17-8-6-5-7-15(17)21(24)27-20/h5-10,12-13H,3-4,11H2,1-2H3/b16-12-