2-[3-oxidanylidene-4-(pyridin-2-ylmethyl)-1,4-benzoxazin-6-yl]-4,5,6,7-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-[3-oxidanylidene-4-(pyridin-2-ylmethyl)-1,4-benzoxazin-6-yl]-4,5,6,7-tetrahydroisoindole-1,3-dione Openeye Name: 2-[3-oxo-4-(2-pyridylmethyl)-1,4-benzoxazin-6-yl]-4,5,6,7-tetrahydroisoindole-1,3-dione CAS Name: 2-[3-oxo-4-(2-pyridinylmethyl)-1,4-benzoxazin-6-yl]-4,5,6,7-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[3-oxo-4-(pyridin-2-ylmethyl)-1,4-benzoxazin-6-yl]-4,5,6,7-tetrahydroisoindole-1,3-dione Traditional Name: 2-[3-keto-4-(2-pyridylmethyl)-1,4-benzoxazin-6-yl]-4,5,6,7-tetrahydroisoindole-1,3-quinone Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=O)N(C2=O)C3=CC4=C(C=C3)OCC(=O)N4CC5=CC=CC=N5

Isomeric SMILES

C1CCC2=C(C1)C(=O)N(C2=O)C3=CC4=C(C=C3)OCC(=O)N4CC5=CC=CC=N5

InChI

InChI=1S/C22H19N3O4/c26-20-13-29-19-9-8-15(11-18(19)24(20)12-14-5-3-4-10-23-14)25-21(27)16-6-1-2-7-17(16)22(25)28/h3-5,8-11H,1-2,6-7,12-13H2