5-[[2-(butan-2-ylcarbamoyl)phenyl]amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[2-(butan-2-ylcarbamoyl)phenyl]amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid Openeye Name: 3,3-dimethyl-5-oxo-5-[2-(sec-butylcarbamoyl)anilino]pentanoic acid CAS Name: 5-[2-[(butan-2-ylamino)-oxomethyl]anilino]-3,3-dimethyl-5-oxopentanoic acid IUPAC Name: 5-[2-(butan-2-ylcarbamoyl)anilino]-3,3-dimethyl-5-oxopentanoic acid Traditional Name: 5-keto-3,3-dimethyl-5-[2-(sec-butylcarbamoyl)anilino]valeric acid Formula: C18H26N2O4 MolecularWeight: 334.41004

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=CC=C1NC(=O)CC(C)(C)CC(=O)O

Isomeric SMILES

CCC(C)NC(=O)C1=CC=CC=C1NC(=O)CC(C)(C)CC(=O)O

InChI

InChI=1S/C18H26N2O4/c1-5-12(2)19-17(24)13-8-6-7-9-14(13)20-15(21)10-18(3,4)11-16(22)23/h6-9,12H,5,10-11H2,1-4H3,(H,19,24)(H,20,21)(H,22,23)