4-[2-(2-naphthalen-1-ylpropanoylamino)-4-[(2-propan-2-yloxyphenoxy)methyl]phenyl]butanoic acid

Systemtic Name: 4-[2-(2-naphthalen-1-ylpropanoylamino)-4-[(2-propan-2-yloxyphenoxy)methyl]phenyl]butanoic acid Openeye Name: 4-[4-[(2-isopropoxyphenoxy)methyl]-2-[2-(1-naphthyl)propanoylamino]phenyl]butanoic acid CAS Name: 4-[2-[[2-(1-naphthalenyl)-1-oxopropyl]amino]-4-[(2-propan-2-yloxyphenoxy)methyl]phenyl]butanoic acid IUPAC Name: 4-[2-(2-naphthalen-1-ylpropanoylamino)-4-[(2-propan-2-yloxyphenoxy)methyl]phenyl]butanoic acid Traditional Name: 4-[4-[(2-isopropoxyphenoxy)methyl]-2-[2-(1-naphthyl)propanoylamino]phenyl]butyric acid Formula: C33H35NO5 MolecularWeight: 525.6347

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1OCC2=CC(=C(C=C2)CCCC(=O)O)NC(=O)C(C)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)OC1=CC=CC=C1OCC2=CC(=C(C=C2)CCCC(=O)O)NC(=O)C(C)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C33H35NO5/c1-22(2)39-31-16-7-6-15-30(31)38-21-24-18-19-26(12-9-17-32(35)36)29(20-24)34-33(37)23(3)27-14-8-11-25-10-4-5-13-28(25)27/h4-8,10-11,13-16,18-20,22-23H,9,12,17,21H2,1-3H3,(H,34,37)(H,35,36)