[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(4-chloranyl-3-methyl-phenoxy)ethanoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(4-chloranyl-3-methyl-phenoxy)ethanoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2-(4-chloro-3-methyl-phenoxy)acetate CAS Name: 2-(4-chloro-3-methylphenoxy)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-chloro-3-methylphenoxy)acetate Traditional Name: 2-(4-chloro-3-methyl-phenoxy)acetic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C15H15ClN2O4 MolecularWeight: 322.7436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)OCC(=O)C(=C(C)N)C#N)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)OCC(=O)/C(=C(\C)/N)/C#N)Cl

InChI

InChI=1S/C15H15ClN2O4/c1-9-5-11(3-4-13(9)16)21-8-15(20)22-7-14(19)12(6-17)10(2)18/h3-5H,7-8,18H2,1-2H3/b12-10+