(3S)-3-methyl-5-oxidanylidene-5-[(4-propan-2-ylphenyl)amino]pentanoic acid

Systemtic Name: (3S)-3-methyl-5-oxidanylidene-5-[(4-propan-2-ylphenyl)amino]pentanoic acid Openeye Name: (3S)-5-(4-isopropylanilino)-3-methyl-5-oxo-pentanoic acid CAS Name: (3S)-3-methyl-5-oxo-5-(4-propan-2-ylanilino)pentanoic acid IUPAC Name: (3S)-3-methyl-5-oxo-5-(4-propan-2-ylanilino)pentanoic acid Traditional Name: (3S)-5-cumidino-5-keto-3-methyl-valeric acid Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](CC(=O)NC1=CC=C(C=C1)C(C)C)CC(=O)O

InChI

InChI=1S/C15H21NO3/c1-10(2)12-4-6-13(7-5-12)16-14(17)8-11(3)9-15(18)19/h4-7,10-11H,8-9H2,1-3H3,(H,16,17)(H,18,19)/t11-/m0/s1