4-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]butanoic acid

Systemtic Name: 4-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]butanoic acid Openeye Name: 4-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)butanoic acid CAS Name: 4-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)butanoic acid IUPAC Name: 4-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)butanoic acid Traditional Name: 4-(1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)butyric acid Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2C1C(=O)N(C2=O)CCCC(=O)O

Isomeric SMILES

C1C=CCC2C1C(=O)N(C2=O)CCCC(=O)O

InChI

InChI=1S/C12H15NO4/c14-10(15)6-3-7-13-11(16)8-4-1-2-5-9(8)12(13)17/h1-2,8-9H,3-7H2,(H,14,15)