3-(3-methylbut-2-enoylamino)-3-phenyl-propanoic acid

Systemtic Name: 3-(3-methylbut-2-enoylamino)-3-phenyl-propanoic acid Openeye Name: 3-(3-methylbut-2-enoylamino)-3-phenyl-propanoic acid CAS Name: 3-[(3-methyl-1-oxobut-2-enyl)amino]-3-phenylpropanoic acid IUPAC Name: 3-(3-methylbut-2-enoylamino)-3-phenylpropanoic acid Traditional Name: 3-(3-methylbut-2-enoylamino)-3-phenyl-propionic acid Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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