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

Systemtic Name: 5-(6-nitro-1,3-benzoxazol-2-yl)-2-propyl-isoindole-1,3-dione Openeye Name: 5-(6-nitro-1,3-benzoxazol-2-yl)-2-propyl-isoindoline-1,3-dione CAS Name: 5-(6-nitro-1,3-benzoxazol-2-yl)-2-propylisoindole-1,3-dione IUPAC Name: 5-(6-nitro-1,3-benzoxazol-2-yl)-2-propylisoindole-1,3-dione Traditional Name: 5-(6-nitro-1,3-benzoxazol-2-yl)-2-propyl-isoindoline-1,3-quinone Formula: C18H13N3O5 MolecularWeight: 351.31292

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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=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCN1C(=O)C2=C(C1=O)C=C(C=C2)C3=NC4=C(O3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H13N3O5/c1-2-7-20-17(22)12-5-3-10(8-13(12)18(20)23)16-19-14-6-4-11(21(24)25)9-15(14)26-16/h3-6,8-9H,2,7H2,1H3