2-[3-[2-(4-methyl-3-oxidanylidene-1,4-benzoxazin-7-yl)ethylamino]propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[2-(4-methyl-3-oxidanylidene-1,4-benzoxazin-7-yl)ethylamino]propyl]isoindole-1,3-dione Openeye Name: 2-[3-[2-(4-methyl-3-oxo-1,4-benzoxazin-7-yl)ethylamino]propyl]isoindoline-1,3-dione CAS Name: 2-[3-[2-(4-methyl-3-oxo-1,4-benzoxazin-7-yl)ethylamino]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-[2-(4-methyl-3-oxo-1,4-benzoxazin-7-yl)ethylamino]propyl]isoindole-1,3-dione Traditional Name: 2-[3-[2-(3-keto-4-methyl-1,4-benzoxazin-7-yl)ethylamino]propyl]isoindoline-1,3-quinone Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)COC2=C1C=CC(=C2)CCNCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CN1C(=O)COC2=C1C=CC(=C2)CCNCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H23N3O4/c1-24-18-8-7-15(13-19(18)29-14-20(24)26)9-11-23-10-4-12-25-21(27)16-5-2-3-6-17(16)22(25)28/h2-3,5-8,13,23H,4,9-12,14H2,1H3