ethyl 4-chloranyl-2-(1,3-dihydroperimidin-2-ylidene)-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-chloranyl-2-(1,3-dihydroperimidin-2-ylidene)-3-oxidanylidene-butanoate Openeye Name: ethyl 4-chloro-2-(1,3-dihydroperimidin-2-ylidene)-3-oxo-butanoate CAS Name: 4-chloro-2-(1,3-dihydroperimidin-2-ylidene)-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-chloro-2-(1,3-dihydroperimidin-2-ylidene)-3-oxobutanoate Traditional Name: 4-chloro-2-(1,3-dihydroperimidin-2-ylidene)-3-keto-butyric acid ethyl ester Formula: C17H15ClN2O3 MolecularWeight: 330.7656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1NC2=CC=CC3=C2C(=CC=C3)N1)C(=O)CCl

Isomeric SMILES

CCOC(=O)C(=C1NC2=CC=CC3=C2C(=CC=C3)N1)C(=O)CCl

InChI

InChI=1S/C17H15ClN2O3/c1-2-23-17(22)15(13(21)9-18)16-19-11-7-3-5-10-6-4-8-12(20-16)14(10)11/h3-8,19-20H,2,9H2,1H3