methyl (2E,4E)-5-azanyl-4-chloranyl-2-ethanoyl-penta-2,4-dienoate

Systemtic Name: methyl (2E,4E)-5-azanyl-4-chloranyl-2-ethanoyl-penta-2,4-dienoate Openeye Name: methyl (2E,4E)-2-acetyl-5-amino-4-chloro-penta-2,4-dienoate CAS Name: (2E,4E)-2-acetyl-5-amino-4-chloropenta-2,4-dienoic acid methyl ester IUPAC Name: methyl (2E,4E)-2-acetyl-5-amino-4-chloropenta-2,4-dienoate Traditional Name: (2E,4E)-2-acetyl-5-amino-4-chloro-penta-2,4-dienoic acid methyl ester Formula: C8H10ClNO3 MolecularWeight: 203.6229

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC(=CN)Cl)C(=O)OC

Isomeric SMILES

CC(=O)/C(=C\C(=C/N)\Cl)/C(=O)OC

InChI

InChI=1S/C8H10ClNO3/c1-5(11)7(8(12)13-2)3-6(9)4-10/h3-4H,10H2,1-2H3/b6-4+,7-3+