3-[5-[acetamido-(4-hexylphenyl)amino]-2-methyl-phenoxy]propanoic acid

Systemtic Name: 3-[5-[acetamido-(4-hexylphenyl)amino]-2-methyl-phenoxy]propanoic acid Openeye Name: 3-[5-(N-acetamido-4-hexyl-anilino)-2-methyl-phenoxy]propanoic acid CAS Name: 3-[5-(N-acetamido-4-hexylanilino)-2-methylphenoxy]propanoic acid IUPAC Name: 3-[5-(N-acetamido-4-hexylanilino)-2-methylphenoxy]propanoic acid Traditional Name: 3-[5-(N-acetamido-4-hexyl-anilino)-2-methyl-phenoxy]propionic acid Formula: C24H32N2O4 MolecularWeight: 412.52188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)N(C2=CC(=C(C=C2)C)OCCC(=O)O)NC(=O)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)N(C2=CC(=C(C=C2)C)OCCC(=O)O)NC(=O)C

InChI

InChI=1S/C24H32N2O4/c1-4-5-6-7-8-20-10-13-21(14-11-20)26(25-19(3)27)22-12-9-18(2)23(17-22)30-16-15-24(28)29/h9-14,17H,4-8,15-16H2,1-3H3,(H,25,27)(H,28,29)