5-[(4-ethylphenyl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(4-ethylphenyl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-(4-ethylanilino)-3,3-dimethyl-5-oxo-pentanoic acid CAS Name: 5-(4-ethylanilino)-3,3-dimethyl-5-oxopentanoic acid IUPAC Name: 5-(4-ethylanilino)-3,3-dimethyl-5-oxopentanoic acid Traditional Name: 5-(4-ethylanilino)-5-keto-3,3-dimethyl-valeric acid Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CC(C)(C)CC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CC(C)(C)CC(=O)O

InChI

InChI=1S/C15H21NO3/c1-4-11-5-7-12(8-6-11)16-13(17)9-15(2,3)10-14(18)19/h5-8H,4,9-10H2,1-3H3,(H,16,17)(H,18,19)