2-ethylhexyl 3-[(4,4-dimethyl-3-oxidanylidene-pentanoyl)amino]-4-oxidanyl-benzoate

Systemtic Name: 2-ethylhexyl 3-[(4,4-dimethyl-3-oxidanylidene-pentanoyl)amino]-4-oxidanyl-benzoate Openeye Name: 2-ethylhexyl 3-[(4,4-dimethyl-3-oxo-pentanoyl)amino]-4-hydroxy-benzoate CAS Name: 3-[(4,4-dimethyl-1,3-dioxopentyl)amino]-4-hydroxybenzoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl 3-[(4,4-dimethyl-3-oxopentanoyl)amino]-4-hydroxybenzoate Traditional Name: 4-hydroxy-3-[(3-keto-4,4-dimethyl-pentanoyl)amino]benzoic acid 2-ethylhexyl ester Formula: C22H33NO5 MolecularWeight: 391.50112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C1=CC(=C(C=C1)O)NC(=O)CC(=O)C(C)(C)C

Isomeric SMILES

CCCCC(CC)COC(=O)C1=CC(=C(C=C1)O)NC(=O)CC(=O)C(C)(C)C

InChI

InChI=1S/C22H33NO5/c1-6-8-9-15(7-2)14-28-21(27)16-10-11-18(24)17(12-16)23-20(26)13-19(25)22(3,4)5/h10-12,15,24H,6-9,13-14H2,1-5H3,(H,23,26)