(2S)-2-[(2R)-4-[(2-methoxyphenyl)amino]-4-oxidanylidene-butan-2-yl]hexanoate

Systemtic Name: (2S)-2-[(2R)-4-[(2-methoxyphenyl)amino]-4-oxidanylidene-butan-2-yl]hexanoate Openeye Name: (2S)-2-[(1R)-3-(2-methoxyanilino)-1-methyl-3-oxo-propyl]hexanoate CAS Name: (2S)-2-[(2R)-4-(2-methoxyanilino)-4-oxobutan-2-yl]hexanoate IUPAC Name: (2S)-2-[(2R)-4-(2-methoxyanilino)-4-oxobutan-2-yl]hexanoate Traditional Name: (2S)-2-[(1R)-3-keto-1-methyl-3-(o-anisidino)propyl]hexanoate Formula: C17H24NO4- MolecularWeight: 306.37676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)CC(=O)NC1=CC=CC=C1OC)C(=O)[O-]

Isomeric SMILES

CCCC[C@@H]([C@H](C)CC(=O)NC1=CC=CC=C1OC)C(=O)[O-]

InChI

InChI=1S/C17H25NO4/c1-4-5-8-13(17(20)21)12(2)11-16(19)18-14-9-6-7-10-15(14)22-3/h6-7,9-10,12-13H,4-5,8,11H2,1-3H3,(H,18,19)(H,20,21)/p-1/t12-,13+/m1/s1