2-methoxyethyl (E)-3-(5-bromanyl-2-prop-2-ynoxy-phenyl)-2-cyano-prop-2-enoate

Systemtic Name: 2-methoxyethyl (E)-3-(5-bromanyl-2-prop-2-ynoxy-phenyl)-2-cyano-prop-2-enoate Openeye Name: 2-methoxyethyl (E)-3-(5-bromo-2-prop-2-ynoxy-phenyl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(5-bromo-2-prop-2-ynoxyphenyl)-2-cyano-2-propenoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (E)-3-(5-bromo-2-prop-2-ynoxyphenyl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(5-bromo-2-propargyloxy-phenyl)-2-cyano-acrylic acid 2-methoxyethyl ester Formula: C16H14BrNO4 MolecularWeight: 364.19066

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C(=CC1=C(C=CC(=C1)Br)OCC#C)C#N

Isomeric SMILES

COCCOC(=O)/C(=C/C1=C(C=CC(=C1)Br)OCC#C)/C#N

InChI

InChI=1S/C16H14BrNO4/c1-3-6-21-15-5-4-14(17)10-12(15)9-13(11-18)16(19)22-8-7-20-2/h1,4-5,9-10H,6-8H2,2H3/b13-9+