[1-[2,5-bis(oxidanylidene)pyrrol-1-yl]-3-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)propan-2-yl] ethanoate

Systemtic Name: [1-[2,5-bis(oxidanylidene)pyrrol-1-yl]-3-(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)propan-2-yl] ethanoate Openeye Name: [1-[(3-tert-butyl-4-hydroxy-5-methyl-phenyl)methyl]-2-(2,5-dioxopyrrol-1-yl)ethyl] acetate CAS Name: acetic acid [1-(3-tert-butyl-4-hydroxy-5-methylphenyl)-3-(2,5-dioxo-1-pyrrolyl)propan-2-yl] ester IUPAC Name: [1-(3-tert-butyl-4-hydroxy-5-methylphenyl)-3-(2,5-dioxopyrrol-1-yl)propan-2-yl] acetate Traditional Name: acetic acid [1-(3-tert-butyl-4-hydroxy-5-methyl-benzyl)-2-maleimido-ethyl] ester Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CC(CN2C(=O)C=CC2=O)OC(=O)C)C(C)(C)C)O

Isomeric SMILES

CC1=C(C(=CC(=C1)CC(CN2C(=O)C=CC2=O)OC(=O)C)C(C)(C)C)O

InChI

InChI=1S/C20H25NO5/c1-12-8-14(10-16(19(12)25)20(3,4)5)9-15(26-13(2)22)11-21-17(23)6-7-18(21)24/h6-8,10,15,25H,9,11H2,1-5H3