(E)-2-acetamido-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-2-acetamido-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-2-acetamido-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoic acid CAS Name: (E)-2-acetamido-3-(4-butoxy-3-ethoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-acetamido-3-(4-butoxy-3-ethoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-acetamido-3-(4-butoxy-3-ethoxy-phenyl)acrylic acid Formula: C17H23NO5 MolecularWeight: 321.36822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO5/c1-4-6-9-23-15-8-7-13(11-16(15)22-5-2)10-14(17(20)21)18-12(3)19/h7-8,10-11H,4-6,9H2,1-3H3,(H,18,19)(H,20,21)/b14-10+