(E)-3-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(4-benzyloxy-3-bromo-5-methoxy-phenyl)prop-2-enoic acid CAS Name: (E)-3-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(4-benzoxy-3-bromo-5-methoxy-phenyl)acrylic acid Formula: C17H15BrO4 MolecularWeight: 363.2026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrO4/c1-21-15-10-13(7-8-16(19)20)9-14(18)17(15)22-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,19,20)/b8-7+