(5-phenyl-1,2-oxazol-3-yl)methyl (E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoate

Systemtic Name: (5-phenyl-1,2-oxazol-3-yl)methyl (E)-3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoate Openeye Name: (5-phenylisoxazol-3-yl)methyl (E)-3-(3-chloro-4,5-dimethoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-chloro-4,5-dimethoxyphenyl)-2-propenoic acid (5-phenyl-3-isoxazolyl)methyl ester IUPAC Name: (5-phenyl-1,2-oxazol-3-yl)methyl (E)-3-(3-chloro-4,5-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-chloro-4,5-dimethoxy-phenyl)acrylic acid (5-phenylisoxazol-3-yl)methyl ester Formula: C21H18ClNO5 MolecularWeight: 399.82432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)OCC2=NOC(=C2)C3=CC=CC=C3)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)OCC2=NOC(=C2)C3=CC=CC=C3)Cl)OC

InChI

InChI=1S/C21H18ClNO5/c1-25-19-11-14(10-17(22)21(19)26-2)8-9-20(24)27-13-16-12-18(28-23-16)15-6-4-3-5-7-15/h3-12H,13H2,1-2H3/b9-8+