3-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]pentanoic acid

Systemtic Name: 3-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]pentanoic acid Openeye Name: 3-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]pentanoic acid CAS Name: 3-methyl-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]pentanoic acid IUPAC Name: 3-methyl-2-[[(E)-3-phenylprop-2-enoyl]amino]pentanoic acid Traditional Name: 3-methyl-2-[[(E)-3-phenylacryloyl]amino]valeric acid Formula: C15H19NO3 MolecularWeight: 261.31626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO3/c1-3-11(2)14(15(18)19)16-13(17)10-9-12-7-5-4-6-8-12/h4-11,14H,3H2,1-2H3,(H,16,17)(H,18,19)/b10-9+