2-methylpropyl 4-[[(E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: 2-methylpropyl 4-[[(E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoyl]amino]benzoate Openeye Name: isobutyl 4-[[(E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(4-butoxy-3-ethoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[[(E)-3-(4-butoxy-3-ethoxyphenyl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(4-butoxy-3-ethoxy-phenyl)acryloyl]amino]benzoic acid isobutyl ester Formula: C26H33NO5 MolecularWeight: 439.54392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=CC(=O)NC2=CC=C(C=C2)C(=O)OCC(C)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C/C(=O)NC2=CC=C(C=C2)C(=O)OCC(C)C)OCC

InChI

InChI=1S/C26H33NO5/c1-5-7-16-31-23-14-8-20(17-24(23)30-6-2)9-15-25(28)27-22-12-10-21(11-13-22)26(29)32-18-19(3)4/h8-15,17,19H,5-7,16,18H2,1-4H3,(H,27,28)/b15-9+