2-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]butanoic acid

Systemtic Name: 2-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]butanoic acid Openeye Name: 2-[[(E)-3-(4-isopropylphenyl)prop-2-enoyl]amino]butanoic acid CAS Name: 2-[[(E)-1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]amino]butanoic acid IUPAC Name: 2-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]amino]butanoic acid Traditional Name: 2-[[(E)-3-p-cumenylacryloyl]amino]butyric acid Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO3/c1-4-14(16(19)20)17-15(18)10-7-12-5-8-13(9-6-12)11(2)3/h5-11,14H,4H2,1-3H3,(H,17,18)(H,19,20)/b10-7+