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

Systemtic Name: (E)-2-(3-cyclopentylpropanoylamino)-3-[4-(2-phenylphenoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-2-(3-cyclopentylpropanoylamino)-3-[4-(2-phenylphenoxy)phenyl]prop-2-enoic acid CAS Name: (E)-2-[(3-cyclopentyl-1-oxopropyl)amino]-3-[4-(2-phenylphenoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-2-(3-cyclopentylpropanoylamino)-3-[4-(2-phenylphenoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-2-(3-cyclopentylpropanoylamino)-3-[4-(2-phenylphenoxy)phenyl]acrylic acid Formula: C29H29NO4 MolecularWeight: 455.54486

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)NC(=CC2=CC=C(C=C2)OC3=CC=CC=C3C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CCC(C1)CCC(=O)N/C(=C/C2=CC=C(C=C2)OC3=CC=CC=C3C4=CC=CC=C4)/C(=O)O

InChI

InChI=1S/C29H29NO4/c31-28(19-16-21-8-4-5-9-21)30-26(29(32)33)20-22-14-17-24(18-15-22)34-27-13-7-6-12-25(27)23-10-2-1-3-11-23/h1-3,6-7,10-15,17-18,20-21H,4-5,8-9,16,19H2,(H,30,31)(H,32,33)/b26-20+