2-(3-prop-2-ynoxy-1,2-benzoxazol-5-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Systemtic Name: 2-(3-prop-2-ynoxy-1,2-benzoxazol-5-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Openeye Name: 2-(3-prop-2-ynoxy-1,2-benzoxazol-5-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione CAS Name: 2-(3-prop-2-ynoxy-1,2-benzoxazol-5-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione IUPAC Name: 2-(3-prop-2-ynoxy-1,2-benzoxazol-5-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Traditional Name: 2-(3-propargyloxyindoxazen-5-yl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-quinone Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=NOC2=C1C=C(C=C2)N3C(=O)C4CCCCC4C3=O

Isomeric SMILES

C#CCOC1=NOC2=C1C=C(C=C2)N3C(=O)C4CCCCC4C3=O

InChI

InChI=1S/C18H16N2O4/c1-2-9-23-16-14-10-11(7-8-15(14)24-19-16)20-17(21)12-5-3-4-6-13(12)18(20)22/h1,7-8,10,12-13H,3-6,9H2