2-[4-[[(2,4-dimethoxyphenyl)carbamoyl-octyl-amino]methyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[[(2,4-dimethoxyphenyl)carbamoyl-octyl-amino]methyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[[(2,4-dimethoxyphenyl)carbamoyl-octyl-amino]methyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[[[(2,4-dimethoxyanilino)-oxomethyl]-octylamino]methyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[[(2,4-dimethoxyphenyl)carbamoyl-octylamino]methyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[[(2,4-dimethoxyphenyl)carbamoyl-octyl-amino]methyl]phenoxy]-2-methyl-propionic acid Formula: C28H40N2O6 MolecularWeight: 500.627

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CC1=CC=C(C=C1)OC(C)(C)C(=O)O)C(=O)NC2=C(C=C(C=C2)OC)OC

Isomeric SMILES

CCCCCCCCN(CC1=CC=C(C=C1)OC(C)(C)C(=O)O)C(=O)NC2=C(C=C(C=C2)OC)OC

InChI

InChI=1S/C28H40N2O6/c1-6-7-8-9-10-11-18-30(27(33)29-24-17-16-23(34-4)19-25(24)35-5)20-21-12-14-22(15-13-21)36-28(2,3)26(31)32/h12-17,19H,6-11,18,20H2,1-5H3,(H,29,33)(H,31,32)