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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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