ethyl 2-[3-[(4-chlorophenyl)carbonylamino]isoindol-1-ylidene]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[3-[(4-chlorophenyl)carbonylamino]isoindol-1-ylidene]-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[3-[(4-chlorobenzoyl)amino]isoindol-1-ylidene]-3-oxo-butanoate CAS Name: 2-[3-[[(4-chlorophenyl)-oxomethyl]amino]-1-isoindolylidene]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-[3-[(4-chlorobenzoyl)amino]isoindol-1-ylidene]-3-oxobutanoate Traditional Name: 2-[3-[(4-chlorobenzoyl)amino]isoindol-1-ylidene]-3-keto-butyric acid ethyl ester Formula: C21H17ClN2O4 MolecularWeight: 396.82368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1C2=CC=CC=C2C(=N1)NC(=O)C3=CC=C(C=C3)Cl)C(=O)C

Isomeric SMILES

CCOC(=O)C(=C1C2=CC=CC=C2C(=N1)NC(=O)C3=CC=C(C=C3)Cl)C(=O)C

InChI

InChI=1S/C21H17ClN2O4/c1-3-28-21(27)17(12(2)25)18-15-6-4-5-7-16(15)19(23-18)24-20(26)13-8-10-14(22)11-9-13/h4-11H,3H2,1-2H3,(H,23,24,26)