2-(4-butylphenyl)-5-chloranyl-isoindole-1,3-dione

Systemtic Name: 2-(4-butylphenyl)-5-chloranyl-isoindole-1,3-dione Openeye Name: 2-(4-butylphenyl)-5-chloro-isoindoline-1,3-dione CAS Name: 2-(4-butylphenyl)-5-chloroisoindole-1,3-dione IUPAC Name: 2-(4-butylphenyl)-5-chloroisoindole-1,3-dione Traditional Name: 2-(4-butylphenyl)-5-chloro-isoindoline-1,3-quinone Formula: C18H16ClNO2 MolecularWeight: 313.77814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)Cl

InChI

InChI=1S/C18H16ClNO2/c1-2-3-4-12-5-8-14(9-6-12)20-17(21)15-10-7-13(19)11-16(15)18(20)22/h5-11H,2-4H2,1H3