(2E)-2-[(3-bromanyl-1,4-dimethoxy-naphthalen-2-yl)methylidene]-4-methoxy-butanoic acid

Systemtic Name: (2E)-2-[(3-bromanyl-1,4-dimethoxy-naphthalen-2-yl)methylidene]-4-methoxy-butanoic acid Openeye Name: (2E)-2-[(3-bromo-1,4-dimethoxy-2-naphthyl)methylene]-4-methoxy-butanoic acid CAS Name: (2E)-2-[(3-bromo-1,4-dimethoxy-2-naphthalenyl)methylidene]-4-methoxybutanoic acid IUPAC Name: (2E)-2-[(3-bromo-1,4-dimethoxynaphthalen-2-yl)methylidene]-4-methoxybutanoic acid Traditional Name: (E)-3-(3-bromo-1,4-dimethoxy-2-naphthyl)-2-(2-methoxyethyl)acrylic acid Formula: C18H19BrO5 MolecularWeight: 395.24446

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Descriptors Computed from Structure

Canonical SMILES:

COCCC(=CC1=C(C2=CC=CC=C2C(=C1Br)OC)OC)C(=O)O

Isomeric SMILES

COCC/C(=C\C1=C(C2=CC=CC=C2C(=C1Br)OC)OC)/C(=O)O

InChI

InChI=1S/C18H19BrO5/c1-22-9-8-11(18(20)21)10-14-15(19)17(24-3)13-7-5-4-6-12(13)16(14)23-2/h4-7,10H,8-9H2,1-3H3,(H,20,21)/b11-10+