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

Systemtic Name: 2-(2-oxidanylidene-3-prop-2-ynyl-1,3-benzoxazol-5-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione Openeye Name: 2-(2-oxo-3-prop-2-ynyl-1,3-benzoxazol-5-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione CAS Name: 2-(2-oxo-3-prop-2-ynyl-1,3-benzoxazol-5-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(2-oxo-3-prop-2-ynyl-1,3-benzoxazol-5-yl)-4,5,6,7-tetrahydroisoindole-1,3-dione Traditional Name: 2-(2-keto-3-propargyl-1,3-benzoxazol-5-yl)-4,5,6,7-tetrahydroisoindole-1,3-quinone Formula: C18H14N2O4 MolecularWeight: 322.31476

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=C(C=CC(=C2)N3C(=O)C4=C(C3=O)CCCC4)OC1=O

Isomeric SMILES

C#CCN1C2=C(C=CC(=C2)N3C(=O)C4=C(C3=O)CCCC4)OC1=O

InChI

InChI=1S/C18H14N2O4/c1-2-9-19-14-10-11(7-8-15(14)24-18(19)23)20-16(21)12-5-3-4-6-13(12)17(20)22/h1,7-8,10H,3-6,9H2