6-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]hexanoic acid

Systemtic Name: 6-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]hexanoic acid Openeye Name: 6-[[(E)-3-(p-tolyl)prop-2-enoyl]amino]hexanoic acid CAS Name: 6-[[(E)-3-(4-methylphenyl)-1-oxoprop-2-enyl]amino]hexanoic acid IUPAC Name: 6-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]hexanoic acid Traditional Name: 6-[[(E)-3-(p-tolyl)acryloyl]amino]hexanoic acid Formula: C16H21NO3 MolecularWeight: 275.34284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)NCCCCCC(=O)O

InChI

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