(E)-2-(3-cyclopentylpropanoylamino)-3-(4-phenoxyphenyl)prop-2-enoic acid

Systemtic Name: (E)-2-(3-cyclopentylpropanoylamino)-3-(4-phenoxyphenyl)prop-2-enoic acid Openeye Name: (E)-2-(3-cyclopentylpropanoylamino)-3-(4-phenoxyphenyl)prop-2-enoic acid CAS Name: (E)-2-[(3-cyclopentyl-1-oxopropyl)amino]-3-(4-phenoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-(3-cyclopentylpropanoylamino)-3-(4-phenoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-(3-cyclopentylpropanoylamino)-3-(4-phenoxyphenyl)acrylic acid Formula: C23H25NO4 MolecularWeight: 379.4489

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)NC(=CC2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CCC(C1)CCC(=O)N/C(=C/C2=CC=C(C=C2)OC3=CC=CC=C3)/C(=O)O

InChI

InChI=1S/C23H25NO4/c25-22(15-12-17-6-4-5-7-17)24-21(23(26)27)16-18-10-13-20(14-11-18)28-19-8-2-1-3-9-19/h1-3,8-11,13-14,16-17H,4-7,12,15H2,(H,24,25)(H,26,27)/b21-16+