[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(4-bromophenyl)ethanoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(4-bromophenyl)ethanoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2-(4-bromophenyl)acetate CAS Name: 2-(4-bromophenyl)acetic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2-(4-bromophenyl)acetate Traditional Name: 2-(4-bromophenyl)acetic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C14H13BrN2O3 MolecularWeight: 337.16862

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)CC1=CC=C(C=C1)Br)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)CC1=CC=C(C=C1)Br)/N

InChI

InChI=1S/C14H13BrN2O3/c1-9(17)12(7-16)13(18)8-20-14(19)6-10-2-4-11(15)5-3-10/h2-5H,6,8,17H2,1H3/b12-9+