4-[4-(4-acetamidobutyl)phenyl]-2,3-dimethyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(4-acetamidobutyl)phenyl]-2,3-dimethyl-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(4-acetamidobutyl)phenyl]-2,3-dimethyl-4-oxo-butanoic acid CAS Name: 4-[4-(4-acetamidobutyl)phenyl]-2,3-dimethyl-4-oxobutanoic acid IUPAC Name: 4-[4-(4-acetamidobutyl)phenyl]-2,3-dimethyl-4-oxobutanoic acid Traditional Name: 4-[4-(4-acetamidobutyl)phenyl]-4-keto-2,3-dimethyl-butyric acid Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)C(=O)O)C(=O)C1=CC=C(C=C1)CCCCNC(=O)C

Isomeric SMILES

CC(C(C)C(=O)O)C(=O)C1=CC=C(C=C1)CCCCNC(=O)C

InChI

InChI=1S/C18H25NO4/c1-12(13(2)18(22)23)17(21)16-9-7-15(8-10-16)6-4-5-11-19-14(3)20/h7-10,12-13H,4-6,11H2,1-3H3,(H,19,20)(H,22,23)