(E)-3-[4-(2-cyclopentylphenoxy)phenyl]-2-(3-cyclopentylpropanoylamino)prop-2-enoic acid

Systemtic Name: (E)-3-[4-(2-cyclopentylphenoxy)phenyl]-2-(3-cyclopentylpropanoylamino)prop-2-enoic acid Openeye Name: (E)-3-[4-(2-cyclopentylphenoxy)phenyl]-2-(3-cyclopentylpropanoylamino)prop-2-enoic acid CAS Name: (E)-2-[(3-cyclopentyl-1-oxopropyl)amino]-3-[4-(2-cyclopentylphenoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(2-cyclopentylphenoxy)phenyl]-2-(3-cyclopentylpropanoylamino)prop-2-enoic acid Traditional Name: (E)-3-[4-(2-cyclopentylphenoxy)phenyl]-2-(3-cyclopentylpropanoylamino)acrylic acid Formula: C28H33NO4 MolecularWeight: 447.56592

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)NC(=CC2=CC=C(C=C2)OC3=CC=CC=C3C4CCCC4)C(=O)O

Isomeric SMILES

C1CCC(C1)CCC(=O)N/C(=C/C2=CC=C(C=C2)OC3=CC=CC=C3C4CCCC4)/C(=O)O

InChI

InChI=1S/C28H33NO4/c30-27(18-15-20-7-1-2-8-20)29-25(28(31)32)19-21-13-16-23(17-14-21)33-26-12-6-5-11-24(26)22-9-3-4-10-22/h5-6,11-14,16-17,19-20,22H,1-4,7-10,15,18H2,(H,29,30)(H,31,32)/b25-19+