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

Systemtic Name: 2-(2-methyl-3-oxidanylidene-4-prop-2-ynyl-1,4-benzoxazin-6-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione Openeye Name: 2-(2-methyl-3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione CAS Name: 2-(2-methyl-3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(2-methyl-3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione Traditional Name: 2-(3-keto-2-methyl-4-propargyl-1,4-benzoxazin-6-yl)-4,5,6,7-tetrahydroisoindole-1,3-quinone Formula: C20H18N2O4 MolecularWeight: 350.36792

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)N3C(=O)C4=C(C3=O)CCCC4)CC#C

Isomeric SMILES

CC1C(=O)N(C2=C(O1)C=CC(=C2)N3C(=O)C4=C(C3=O)CCCC4)CC#C

InChI

InChI=1S/C20H18N2O4/c1-3-10-21-16-11-13(8-9-17(16)26-12(2)18(21)23)22-19(24)14-6-4-5-7-15(14)20(22)25/h1,8-9,11-12H,4-7,10H2,2H3