2-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]-methyl-amino]ethanoic acid

Systemtic Name: 2-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]-methyl-amino]ethanoic acid Openeye Name: 2-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]-methyl-amino]acetic acid CAS Name: 2-[[(E)-3-(3-cyanophenyl)-1-oxoprop-2-enyl]-methylamino]acetic acid IUPAC Name: 2-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]-methylamino]acetic acid Traditional Name: 2-[[(E)-3-(3-cyanophenyl)acryloyl]-methyl-amino]acetic acid Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)C=CC1=CC=CC(=C1)C#N

Isomeric SMILES

CN(CC(=O)O)C(=O)/C=C/C1=CC=CC(=C1)C#N

InChI

InChI=1S/C13H12N2O3/c1-15(9-13(17)18)12(16)6-5-10-3-2-4-11(7-10)8-14/h2-7H,9H2,1H3,(H,17,18)/b6-5+