butyl 2-methyl-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindole-4-carboxylate

Systemtic Name: butyl 2-methyl-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindole-4-carboxylate Openeye Name: butyl 2-methyl-1,3-dioxo-3a,4,7,7a-tetrahydroisoindole-4-carboxylate CAS Name: 2-methyl-1,3-dioxo-3a,4,7,7a-tetrahydroisoindole-4-carboxylic acid butyl ester IUPAC Name: butyl 2-methyl-1,3-dioxo-3a,4,7,7a-tetrahydroisoindole-4-carboxylate Traditional Name: 1,3-diketo-2-methyl-3a,4,7,7a-tetrahydroisoindole-4-carboxylic acid butyl ester Formula: C14H19NO4 MolecularWeight: 265.30496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1C=CCC2C1C(=O)N(C2=O)C

Isomeric SMILES

CCCCOC(=O)C1C=CCC2C1C(=O)N(C2=O)C

InChI

InChI=1S/C14H19NO4/c1-3-4-8-19-14(18)10-7-5-6-9-11(10)13(17)15(2)12(9)16/h5,7,9-11H,3-4,6,8H2,1-2H3