sodium (2S)-2-(2-methylpropylideneamino)-3-phenyl-propanoate

Systemtic Name: sodium (2S)-2-(2-methylpropylideneamino)-3-phenyl-propanoate Openeye Name: sodium (2S)-2-(2-methylpropylideneamino)-3-phenyl-propanoate CAS Name: sodium (2S)-2-(2-methylpropylideneamino)-3-phenylpropanoate IUPAC Name: sodium (2S)-2-(2-methylpropylideneamino)-3-phenylpropanoate Traditional Name: sodium (2S)-2-(2-methylpropylideneamino)-3-phenyl-propionate Formula: C13H16NNaO2 MolecularWeight: 241.26141

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C=NC(CC1=CC=CC=C1)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C)C=N[C@@H](CC1=CC=CC=C1)C(=O)[O-].[Na+]

InChI

InChI=1S/C13H17NO2.Na/c1-10(2)9-14-12(13(15)16)8-11-6-4-3-5-7-11;/h3-7,9-10,12H,8H2,1-2H3,(H,15,16);/q;+1/p-1/t12-;/m0./s1