2-methyl-3-[4-[3-[(4-methylphenyl)carbamoyl-phenyl-amino]propoxy]phenyl]-2-phenoxy-propanoic acid

Systemtic Name: 2-methyl-3-[4-[3-[(4-methylphenyl)carbamoyl-phenyl-amino]propoxy]phenyl]-2-phenoxy-propanoic acid Openeye Name: 2-methyl-2-phenoxy-3-[4-[3-[N-(p-tolylcarbamoyl)anilino]propoxy]phenyl]propanoic acid CAS Name: 2-methyl-3-[4-[3-(N-[(4-methylanilino)-oxomethyl]anilino)propoxy]phenyl]-2-phenoxypropanoic acid IUPAC Name: 2-methyl-3-[4-[3-[N-[(4-methylphenyl)carbamoyl]anilino]propoxy]phenyl]-2-phenoxypropanoic acid Traditional Name: 2-methyl-2-phenoxy-3-[4-[3-[N-(p-tolylcarbamoyl)anilino]propoxy]phenyl]propionic acid Formula: C33H34N2O5 MolecularWeight: 538.63346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N(CCCOC2=CC=C(C=C2)CC(C)(C(=O)O)OC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N(CCCOC2=CC=C(C=C2)CC(C)(C(=O)O)OC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C33H34N2O5/c1-25-14-18-27(19-15-25)34-32(38)35(28-10-5-3-6-11-28)22-9-23-39-29-20-16-26(17-21-29)24-33(2,31(36)37)40-30-12-7-4-8-13-30/h3-8,10-21H,9,22-24H2,1-2H3,(H,34,38)(H,36,37)