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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)COC2=C1C=CC(=C2)CCCCNCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CN1C(=O)COC2=C1C=CC(=C2)CCCCNCCN3C(=O)C4=CC=CC=C4C3=O

InChI

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