2-ethyl-3-(phenylmethyl)imino-butanoic acid

Systemtic Name: 2-ethyl-3-(phenylmethyl)imino-butanoic acid Openeye Name: 3-benzylimino-2-ethyl-butanoic acid CAS Name: 2-ethyl-3-(phenylmethyl)iminobutanoic acid IUPAC Name: 3-benzylimino-2-ethylbutanoic acid Traditional Name: 3-benzylimino-2-ethyl-butyric acid Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=NCC1=CC=CC=C1)C)C(=O)O

Isomeric SMILES

CCC(C(=NCC1=CC=CC=C1)C)C(=O)O

InChI

InChI=1S/C13H17NO2/c1-3-12(13(15)16)10(2)14-9-11-7-5-4-6-8-11/h4-8,12H,3,9H2,1-2H3,(H,15,16)