(E)-2-acetamido-3-(4-butoxyphenyl)prop-2-enoic acid

Systemtic Name: (E)-2-acetamido-3-(4-butoxyphenyl)prop-2-enoic acid Openeye Name: (E)-2-acetamido-3-(4-butoxyphenyl)prop-2-enoic acid CAS Name: (E)-2-acetamido-3-(4-butoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-acetamido-3-(4-butoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-acetamido-3-(4-butoxyphenyl)acrylic acid Formula: C15H19NO4 MolecularWeight: 277.31566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C(=O)O)NC(=O)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C(=O)O)/NC(=O)C

InChI

InChI=1S/C15H19NO4/c1-3-4-9-20-13-7-5-12(6-8-13)10-14(15(18)19)16-11(2)17/h5-8,10H,3-4,9H2,1-2H3,(H,16,17)(H,18,19)/b14-10+