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

Systemtic Name: 2-[4-[2-(4-methyl-3-oxidanylidene-1,4-benzoxazin-7-yl)ethylamino]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[2-(4-methyl-3-oxo-1,4-benzoxazin-7-yl)ethylamino]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[2-(4-methyl-3-oxo-1,4-benzoxazin-7-yl)ethylamino]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[2-(4-methyl-3-oxo-1,4-benzoxazin-7-yl)ethylamino]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[2-(3-keto-4-methyl-1,4-benzoxazin-7-yl)ethylamino]butyl]isoindoline-1,3-quinone Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)COC2=C1C=CC(=C2)CCNCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CN1C(=O)COC2=C1C=CC(=C2)CCNCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H25N3O4/c1-25-19-9-8-16(14-20(19)30-15-21(25)27)10-12-24-11-4-5-13-26-22(28)17-6-2-3-7-18(17)23(26)29/h2-3,6-9,14,24H,4-5,10-13,15H2,1H3