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

Systemtic Name: 2-[2-[2-(4-methyl-3-oxidanylidene-1,4-benzoxazin-7-yl)ethylamino]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[2-(4-methyl-3-oxo-1,4-benzoxazin-7-yl)ethylamino]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[2-(4-methyl-3-oxo-1,4-benzoxazin-7-yl)ethylamino]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[2-(4-methyl-3-oxo-1,4-benzoxazin-7-yl)ethylamino]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[2-(3-keto-4-methyl-1,4-benzoxazin-7-yl)ethylamino]ethyl]isoindoline-1,3-quinone Formula: C21H21N3O4 MolecularWeight: 379.40914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)COC2=C1C=CC(=C2)CCNCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CN1C(=O)COC2=C1C=CC(=C2)CCNCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H21N3O4/c1-23-17-7-6-14(12-18(17)28-13-19(23)25)8-9-22-10-11-24-20(26)15-4-2-3-5-16(15)21(24)27/h2-7,12,22H,8-11,13H2,1H3