5-(5-tert-butyl-1,3-benzoxazol-2-yl)-2-propyl-isoindole-1,3-dione

Systemtic Name: 5-(5-tert-butyl-1,3-benzoxazol-2-yl)-2-propyl-isoindole-1,3-dione Openeye Name: 5-(5-tert-butyl-1,3-benzoxazol-2-yl)-2-propyl-isoindoline-1,3-dione CAS Name: 5-(5-tert-butyl-1,3-benzoxazol-2-yl)-2-propylisoindole-1,3-dione IUPAC Name: 5-(5-tert-butyl-1,3-benzoxazol-2-yl)-2-propylisoindole-1,3-dione Traditional Name: 5-(5-tert-butyl-1,3-benzoxazol-2-yl)-2-propyl-isoindoline-1,3-quinone Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C1=O)C=C(C=C2)C3=NC4=C(O3)C=CC(=C4)C(C)(C)C

Isomeric SMILES

CCCN1C(=O)C2=C(C1=O)C=C(C=C2)C3=NC4=C(O3)C=CC(=C4)C(C)(C)C

InChI

InChI=1S/C22H22N2O3/c1-5-10-24-20(25)15-8-6-13(11-16(15)21(24)26)19-23-17-12-14(22(2,3)4)7-9-18(17)27-19/h6-9,11-12H,5,10H2,1-4H3