3-[(4-cyanophenyl)methylamino]-2-ethoxy-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[(4-cyanophenyl)methylamino]-2-ethoxy-3-oxidanylidene-propanoic acid Openeye Name: 3-[(4-cyanophenyl)methylamino]-2-ethoxy-3-oxo-propanoic acid CAS Name: 3-[(4-cyanophenyl)methylamino]-2-ethoxy-3-oxopropanoic acid IUPAC Name: 3-[(4-cyanophenyl)methylamino]-2-ethoxy-3-oxopropanoic acid Traditional Name: 3-[(4-cyanobenzyl)amino]-2-ethoxy-3-keto-propionic acid Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(=O)NCC1=CC=C(C=C1)C#N)C(=O)O

Isomeric SMILES

CCOC(C(=O)NCC1=CC=C(C=C1)C#N)C(=O)O

InChI

InChI=1S/C13H14N2O4/c1-2-19-11(13(17)18)12(16)15-8-10-5-3-9(7-14)4-6-10/h3-6,11H,2,8H2,1H3,(H,15,16)(H,17,18)