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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClNO4/c1-3-4-11-26-19-13-14(9-10-18(19)25-2)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-