4-butoxy-5,6-bis(chloranyl)benzo[e]isoindole-1,3-dione

Systemtic Name: 4-butoxy-5,6-bis(chloranyl)benzo[e]isoindole-1,3-dione Openeye Name: 4-butoxy-5,6-dichloro-benzo[e]isoindole-1,3-dione CAS Name: 4-butoxy-5,6-dichlorobenzo[e]isoindole-1,3-dione IUPAC Name: 4-butoxy-5,6-dichlorobenzo[e]isoindole-1,3-dione Traditional Name: 4-butoxy-5,6-dichloro-benz[e]isoindole-1,3-quinone Formula: C16H13Cl2NO3 MolecularWeight: 338.18532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C2=C(C=CC=C2Cl)C3=C1C(=O)NC3=O)Cl

Isomeric SMILES

CCCCOC1=C(C2=C(C=CC=C2Cl)C3=C1C(=O)NC3=O)Cl

InChI

InChI=1S/C16H13Cl2NO3/c1-2-3-7-22-14-12-11(15(20)19-16(12)21)8-5-4-6-9(17)10(8)13(14)18/h4-6H,2-3,7H2,1H3,(H,19,20,21)