2-(2-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-(2-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione Openeye Name: 2-(2-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione CAS Name: 2-(2-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(2-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione Traditional Name: 2-(2-propargyl-2H-1,4-benzoxazin-6-yl)-4,5,6,7-tetrahydroisoindole-1,3-quinone Formula: C19H16N2O3 MolecularWeight: 320.34194

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC1C=NC2=C(O1)C=CC(=C2)N3C(=O)C4=C(C3=O)CCCC4

Isomeric SMILES

C#CCC1C=NC2=C(O1)C=CC(=C2)N3C(=O)C4=C(C3=O)CCCC4

InChI

InChI=1S/C19H16N2O3/c1-2-5-13-11-20-16-10-12(8-9-17(16)24-13)21-18(22)14-6-3-4-7-15(14)19(21)23/h1,8-11,13H,3-7H2