5-[4-[[(2,4-dimethoxyphenyl)carbamoyl-heptyl-amino]methyl]phenoxy]-2,2-dimethyl-pentanoic acid

Systemtic Name: 5-[4-[[(2,4-dimethoxyphenyl)carbamoyl-heptyl-amino]methyl]phenoxy]-2,2-dimethyl-pentanoic acid Openeye Name: 5-[4-[[(2,4-dimethoxyphenyl)carbamoyl-heptyl-amino]methyl]phenoxy]-2,2-dimethyl-pentanoic acid CAS Name: 5-[4-[[[(2,4-dimethoxyanilino)-oxomethyl]-heptylamino]methyl]phenoxy]-2,2-dimethylpentanoic acid IUPAC Name: 5-[4-[[(2,4-dimethoxyphenyl)carbamoyl-heptylamino]methyl]phenoxy]-2,2-dimethylpentanoic acid Traditional Name: 5-[4-[[(2,4-dimethoxyphenyl)carbamoyl-heptyl-amino]methyl]phenoxy]-2,2-dimethyl-valeric acid Formula: C30H44N2O6 MolecularWeight: 528.68016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CC1=CC=C(C=C1)OCCCC(C)(C)C(=O)O)C(=O)NC2=C(C=C(C=C2)OC)OC

Isomeric SMILES

CCCCCCCN(CC1=CC=C(C=C1)OCCCC(C)(C)C(=O)O)C(=O)NC2=C(C=C(C=C2)OC)OC

InChI

InChI=1S/C30H44N2O6/c1-6-7-8-9-10-19-32(29(35)31-26-17-16-25(36-4)21-27(26)37-5)22-23-12-14-24(15-13-23)38-20-11-18-30(2,3)28(33)34/h12-17,21H,6-11,18-20,22H2,1-5H3,(H,31,35)(H,33,34)