butyl 4-[5-methyl-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]benzoate

Systemtic Name: butyl 4-[5-methyl-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]benzoate Openeye Name: butyl 4-(5-methyl-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)benzoate CAS Name: 4-(5-methyl-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)benzoic acid butyl ester IUPAC Name: butyl 4-(5-methyl-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)benzoate Traditional Name: 4-(1,3-diketo-5-methyl-3a,4,7,7a-tetrahydroisoindol-2-yl)benzoic acid butyl ester Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)N2C(=O)C3CC=C(CC3C2=O)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)N2C(=O)C3CC=C(CC3C2=O)C

InChI

InChI=1S/C20H23NO4/c1-3-4-11-25-20(24)14-6-8-15(9-7-14)21-18(22)16-10-5-13(2)12-17(16)19(21)23/h5-9,16-17H,3-4,10-12H2,1-2H3