(3S)-5-[(4-ethoxyphenyl)amino]-3-methyl-5-oxidanylidene-pentanoate

Systemtic Name: (3S)-5-[(4-ethoxyphenyl)amino]-3-methyl-5-oxidanylidene-pentanoate Openeye Name: (3S)-5-(4-ethoxyanilino)-3-methyl-5-oxo-pentanoate CAS Name: (3S)-5-(4-ethoxyanilino)-3-methyl-5-oxopentanoate IUPAC Name: (3S)-5-(4-ethoxyanilino)-3-methyl-5-oxopentanoate Traditional Name: (3S)-5-keto-3-methyl-5-(p-phenetidino)valerate Formula: C14H18NO4- MolecularWeight: 264.29702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CC(C)CC(=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C[C@H](C)CC(=O)[O-]

InChI

InChI=1S/C14H19NO4/c1-3-19-12-6-4-11(5-7-12)15-13(16)8-10(2)9-14(17)18/h4-7,10H,3,8-9H2,1-2H3,(H,15,16)(H,17,18)/p-1/t10-/m0/s1