(3-chlorophenyl)methyl (E)-3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)prop-2-enoate

Systemtic Name: (3-chlorophenyl)methyl (E)-3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)prop-2-enoate Openeye Name: (3-chlorophenyl)methyl (E)-3-(3-bromo-4-hydroxy-5-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-propenoic acid (3-chlorophenyl)methyl ester IUPAC Name: (3-chlorophenyl)methyl (E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-bromo-4-hydroxy-5-methoxy-phenyl)acrylic acid (3-chlorobenzyl) ester Formula: C17H14BrClO4 MolecularWeight: 397.64766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)OCC2=CC(=CC=C2)Cl)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)OCC2=CC(=CC=C2)Cl)Br)O

InChI

InChI=1S/C17H14BrClO4/c1-22-15-9-11(8-14(18)17(15)21)5-6-16(20)23-10-12-3-2-4-13(19)7-12/h2-9,21H,10H2,1H3/b6-5+