2-[4-[3-[(2,4-dimethoxyphenyl)carbamoyl-heptyl-amino]propyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[3-[(2,4-dimethoxyphenyl)carbamoyl-heptyl-amino]propyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[3-[(2,4-dimethoxyphenyl)carbamoyl-heptyl-amino]propyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[3-[[(2,4-dimethoxyanilino)-oxomethyl]-heptylamino]propyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[3-[(2,4-dimethoxyphenyl)carbamoyl-heptylamino]propyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[3-[(2,4-dimethoxyphenyl)carbamoyl-heptyl-amino]propyl]phenoxy]-2-methyl-propionic acid Formula: C29H42N2O6 MolecularWeight: 514.65358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCCC1=CC=C(C=C1)OC(C)(C)C(=O)O)C(=O)NC2=C(C=C(C=C2)OC)OC

Isomeric SMILES

CCCCCCCN(CCCC1=CC=C(C=C1)OC(C)(C)C(=O)O)C(=O)NC2=C(C=C(C=C2)OC)OC

InChI

InChI=1S/C29H42N2O6/c1-6-7-8-9-10-19-31(28(34)30-25-18-17-24(35-4)21-26(25)36-5)20-11-12-22-13-15-23(16-14-22)37-29(2,3)27(32)33/h13-18,21H,6-12,19-20H2,1-5H3,(H,30,34)(H,32,33)