octan-2-yl 2-(3,4-dichlorophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: octan-2-yl 2-(3,4-dichlorophenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 1-methylheptyl 2-(3,4-dichlorophenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(3,4-dichlorophenyl)-1,3-dioxo-5-isoindolecarboxylic acid octan-2-yl ester IUPAC Name: octan-2-yl 2-(3,4-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(3,4-dichlorophenyl)-1,3-diketo-isoindoline-5-carboxylic acid 1-methylheptyl ester Formula: C23H23Cl2NO4 MolecularWeight: 448.33902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C23H23Cl2NO4/c1-3-4-5-6-7-14(2)30-23(29)15-8-10-17-18(12-15)22(28)26(21(17)27)16-9-11-19(24)20(25)13-16/h8-14H,3-7H2,1-2H3