2-[3-(6-ethanoyl-2,3-dihydro-1,4-benzoxazin-4-yl)propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-(6-ethanoyl-2,3-dihydro-1,4-benzoxazin-4-yl)propyl]isoindole-1,3-dione Openeye Name: 2-[3-(6-acetyl-2,3-dihydro-1,4-benzoxazin-4-yl)propyl]isoindoline-1,3-dione CAS Name: 2-[3-(6-acetyl-2,3-dihydro-1,4-benzoxazin-4-yl)propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(6-acetyl-2,3-dihydro-1,4-benzoxazin-4-yl)propyl]isoindole-1,3-dione Traditional Name: 2-[3-(6-acetyl-2,3-dihydro-1,4-benzoxazin-4-yl)propyl]isoindoline-1,3-quinone Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OCCN2CCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OCCN2CCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H20N2O4/c1-14(24)15-7-8-19-18(13-15)22(11-12-27-19)9-4-10-23-20(25)16-5-2-3-6-17(16)21(23)26/h2-3,5-8,13H,4,9-12H2,1H3