2-[[(E)-4-oxidanylidenepent-2-en-2-yl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[(E)-4-oxidanylidenepent-2-en-2-yl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[(E)-1-methyl-3-oxo-but-1-enyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[(E)-4-oxopent-2-en-2-yl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[(E)-4-oxopent-2-en-2-yl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[(E)-3-keto-1-methyl-but-1-enyl]amino]-3-phenyl-propionic acid Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C)NC(CC1=CC=CC=C1)C(=O)O

Isomeric SMILES

C/C(=C\C(=O)C)/NC(CC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C14H17NO3/c1-10(8-11(2)16)15-13(14(17)18)9-12-6-4-3-5-7-12/h3-8,13,15H,9H2,1-2H3,(H,17,18)/b10-8+