2-(2-methylpropyl)-5-(6-nitro-1,3-benzoxazol-2-yl)isoindole-1,3-dione

Systemtic Name: 2-(2-methylpropyl)-5-(6-nitro-1,3-benzoxazol-2-yl)isoindole-1,3-dione Openeye Name: 2-isobutyl-5-(6-nitro-1,3-benzoxazol-2-yl)isoindoline-1,3-dione CAS Name: 2-(2-methylpropyl)-5-(6-nitro-1,3-benzoxazol-2-yl)isoindole-1,3-dione IUPAC Name: 2-(2-methylpropyl)-5-(6-nitro-1,3-benzoxazol-2-yl)isoindole-1,3-dione Traditional Name: 2-isobutyl-5-(6-nitro-1,3-benzoxazol-2-yl)isoindoline-1,3-quinone Formula: C19H15N3O5 MolecularWeight: 365.3395

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C1=O)C=C(C=C2)C3=NC4=C(O3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C1=O)C=C(C=C2)C3=NC4=C(O3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H15N3O5/c1-10(2)9-21-18(23)13-5-3-11(7-14(13)19(21)24)17-20-15-6-4-12(22(25)26)8-16(15)27-17/h3-8,10H,9H2,1-2H3