1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methyl-pyrrole-2,5-dione

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methyl-pyrrole-2,5-dione Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methyl-pyrrole-2,5-dione CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methylpyrrole-2,5-dione IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methylpyrrole-2,5-dione Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methyl-3-pyrroline-2,5-quinone Formula: C14H13NO4 MolecularWeight: 259.25732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C1=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=CC(=O)N(C1=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C14H13NO4/c1-9-7-13(16)15(14(9)17)10-3-4-11-12(8-10)19-6-2-5-18-11/h3-4,7-8H,2,5-6H2,1H3