propyl (E)-3-(2-bromophenyl)-2-cyano-prop-2-enoate

Systemtic Name: propyl (E)-3-(2-bromophenyl)-2-cyano-prop-2-enoate Openeye Name: propyl (E)-3-(2-bromophenyl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(2-bromophenyl)-2-cyano-2-propenoic acid propyl ester IUPAC Name: propyl (E)-3-(2-bromophenyl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(2-bromophenyl)-2-cyano-acrylic acid propyl ester Formula: C13H12BrNO2 MolecularWeight: 294.14388

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(=CC1=CC=CC=C1Br)C#N

Isomeric SMILES

CCCOC(=O)/C(=C/C1=CC=CC=C1Br)/C#N

InChI

InChI=1S/C13H12BrNO2/c1-2-7-17-13(16)11(9-15)8-10-5-3-4-6-12(10)14/h3-6,8H,2,7H2,1H3/b11-8+