2-[4-[3-(4-phenoxy-2-prop-2-enyl-phenoxy)propylamino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[3-(4-phenoxy-2-prop-2-enyl-phenoxy)propylamino]phenyl]ethanoic acid Openeye Name: 2-[4-[3-(2-allyl-4-phenoxy-phenoxy)propylamino]phenyl]acetic acid CAS Name: 2-[4-[3-(4-phenoxy-2-prop-2-enylphenoxy)propylamino]phenyl]acetic acid IUPAC Name: 2-[4-[3-(4-phenoxy-2-prop-2-enylphenoxy)propylamino]phenyl]acetic acid Traditional Name: 2-[4-[3-(2-allyl-4-phenoxy-phenoxy)propylamino]phenyl]acetic acid Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C=CC(=C1)OC2=CC=CC=C2)OCCCNC3=CC=C(C=C3)CC(=O)O

Isomeric SMILES

C=CCC1=C(C=CC(=C1)OC2=CC=CC=C2)OCCCNC3=CC=C(C=C3)CC(=O)O

InChI

InChI=1S/C26H27NO4/c1-2-7-21-19-24(31-23-8-4-3-5-9-23)14-15-25(21)30-17-6-16-27-22-12-10-20(11-13-22)18-26(28)29/h2-5,8-15,19,27H,1,6-7,16-18H2,(H,28,29)