5-(5-chloranyl-1,3-benzoxazol-2-yl)-2-(3,4-dimethylphenyl)isoindole-1,3-dione

Systemtic Name: 5-(5-chloranyl-1,3-benzoxazol-2-yl)-2-(3,4-dimethylphenyl)isoindole-1,3-dione Openeye Name: 5-(5-chloro-1,3-benzoxazol-2-yl)-2-(3,4-dimethylphenyl)isoindoline-1,3-dione CAS Name: 5-(5-chloro-1,3-benzoxazol-2-yl)-2-(3,4-dimethylphenyl)isoindole-1,3-dione IUPAC Name: 5-(5-chloro-1,3-benzoxazol-2-yl)-2-(3,4-dimethylphenyl)isoindole-1,3-dione Traditional Name: 5-(5-chloro-1,3-benzoxazol-2-yl)-2-(3,4-dimethylphenyl)isoindoline-1,3-quinone Formula: C23H15ClN2O3 MolecularWeight: 402.8298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=C(O4)C=CC(=C5)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=C(O4)C=CC(=C5)Cl)C

InChI

InChI=1S/C23H15ClN2O3/c1-12-3-6-16(9-13(12)2)26-22(27)17-7-4-14(10-18(17)23(26)28)21-25-19-11-15(24)5-8-20(19)29-21/h3-11H,1-2H3