5-[(2,6-diethylphenyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(2,6-diethylphenyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(2,6-diethylanilino)-5-oxo-pentanoic acid CAS Name: 5-(2,6-diethylanilino)-5-oxopentanoic acid IUPAC Name: 5-(2,6-diethylanilino)-5-oxopentanoic acid Traditional Name: 5-(2,6-diethylanilino)-5-keto-valeric acid Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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