propan-2-yl 2-[3-(2-chloranylethanoylamino)isoindol-1-ylidene]-3-oxidanylidene-butanoate

Systemtic Name: propan-2-yl 2-[3-(2-chloranylethanoylamino)isoindol-1-ylidene]-3-oxidanylidene-butanoate Openeye Name: isopropyl 2-[3-[(2-chloroacetyl)amino]isoindol-1-ylidene]-3-oxo-butanoate CAS Name: 2-[3-[(2-chloro-1-oxoethyl)amino]-1-isoindolylidene]-3-oxobutanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[3-[(2-chloroacetyl)amino]isoindol-1-ylidene]-3-oxobutanoate Traditional Name: 2-[3-[(2-chloroacetyl)amino]isoindol-1-ylidene]-3-keto-butyric acid isopropyl ester Formula: C17H17ClN2O4 MolecularWeight: 348.78088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(=C1C2=CC=CC=C2C(=N1)NC(=O)CCl)C(=O)C

Isomeric SMILES

CC(C)OC(=O)C(=C1C2=CC=CC=C2C(=N1)NC(=O)CCl)C(=O)C

InChI

InChI=1S/C17H17ClN2O4/c1-9(2)24-17(23)14(10(3)21)15-11-6-4-5-7-12(11)16(20-15)19-13(22)8-18/h4-7,9H,8H2,1-3H3,(H,19,20,22)