(E)-2-benzamido-3-(3-bromanyl-4,5-dimethoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-2-benzamido-3-(3-bromanyl-4,5-dimethoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-2-benzamido-3-(3-bromo-4,5-dimethoxy-phenyl)prop-2-enoic acid CAS Name: (E)-2-benzamido-3-(3-bromo-4,5-dimethoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-benzamido-3-(3-bromo-4,5-dimethoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-benzamido-3-(3-bromo-4,5-dimethoxy-phenyl)acrylic acid Formula: C18H16BrNO5 MolecularWeight: 406.22734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C(=O)O)NC(=O)C2=CC=CC=C2)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C(\C(=O)O)/NC(=O)C2=CC=CC=C2)Br)OC

InChI

InChI=1S/C18H16BrNO5/c1-24-15-10-11(8-13(19)16(15)25-2)9-14(18(22)23)20-17(21)12-6-4-3-5-7-12/h3-10H,1-2H3,(H,20,21)(H,22,23)/b14-9+