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

Systemtic Name: 5-(5-chloranyl-1,3-benzoxazol-2-yl)-2-(phenylmethyl)isoindole-1,3-dione Openeye Name: 2-benzyl-5-(5-chloro-1,3-benzoxazol-2-yl)isoindoline-1,3-dione CAS Name: 5-(5-chloro-1,3-benzoxazol-2-yl)-2-(phenylmethyl)isoindole-1,3-dione IUPAC Name: 2-benzyl-5-(5-chloro-1,3-benzoxazol-2-yl)isoindole-1,3-dione Traditional Name: 2-benzyl-5-(5-chloro-1,3-benzoxazol-2-yl)isoindoline-1,3-quinone Formula: C22H13ClN2O3 MolecularWeight: 388.80322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=C(O4)C=CC(=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=C(O4)C=CC(=C5)Cl

InChI

InChI=1S/C22H13ClN2O3/c23-15-7-9-19-18(11-15)24-20(28-19)14-6-8-16-17(10-14)22(27)25(21(16)26)12-13-4-2-1-3-5-13/h1-11H,12H2