4-[[(E)-3-(4-ethylphenyl)prop-2-enoyl]-methyl-amino]butanoic acid

Systemtic Name: 4-[[(E)-3-(4-ethylphenyl)prop-2-enoyl]-methyl-amino]butanoic acid Openeye Name: 4-[[(E)-3-(4-ethylphenyl)prop-2-enoyl]-methyl-amino]butanoic acid CAS Name: 4-[[(E)-3-(4-ethylphenyl)-1-oxoprop-2-enyl]-methylamino]butanoic acid IUPAC Name: 4-[[(E)-3-(4-ethylphenyl)prop-2-enoyl]-methylamino]butanoic acid Traditional Name: 4-[[(E)-3-(4-ethylphenyl)acryloyl]-methyl-amino]butyric acid Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=CC(=O)N(C)CCCC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)/C=C/C(=O)N(C)CCCC(=O)O

InChI

InChI=1S/C16H21NO3/c1-3-13-6-8-14(9-7-13)10-11-15(18)17(2)12-4-5-16(19)20/h6-11H,3-5,12H2,1-2H3,(H,19,20)/b11-10+