2-methoxyethyl 3-[3,5-bis(bromanyl)-2-oxidanyl-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: 2-methoxyethyl 3-[3,5-bis(bromanyl)-2-oxidanyl-phenyl]-2-cyano-prop-2-enoate Openeye Name: 2-methoxyethyl 2-cyano-3-(3,5-dibromo-2-hydroxy-phenyl)prop-2-enoate CAS Name: 2-cyano-3-(3,5-dibromo-2-hydroxyphenyl)-2-propenoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 2-cyano-3-(3,5-dibromo-2-hydroxyphenyl)prop-2-enoate Traditional Name: 2-cyano-3-(3,5-dibromo-2-hydroxy-phenyl)acrylic acid 2-methoxyethyl ester Formula: C13H11Br2NO4 MolecularWeight: 405.03874

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C(=CC1=CC(=CC(=C1O)Br)Br)C#N

Isomeric SMILES

COCCOC(=O)C(=CC1=CC(=CC(=C1O)Br)Br)C#N

InChI

InChI=1S/C13H11Br2NO4/c1-19-2-3-20-13(18)9(7-16)4-8-5-10(14)6-11(15)12(8)17/h4-6,17H,2-3H2,1H3