2-[4-[[(4-chloranyl-2-methoxy-phenyl)carbamoyl-heptyl-amino]methyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[[(4-chloranyl-2-methoxy-phenyl)carbamoyl-heptyl-amino]methyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[[(4-chloro-2-methoxy-phenyl)carbamoyl-heptyl-amino]methyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[[[(4-chloro-2-methoxyanilino)-oxomethyl]-heptylamino]methyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[[(4-chloro-2-methoxyphenyl)carbamoyl-heptylamino]methyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[[(4-chloro-2-methoxy-phenyl)carbamoyl-heptyl-amino]methyl]phenoxy]-2-methyl-propionic acid Formula: C26H35ClN2O5 MolecularWeight: 491.0195

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H35ClN2O5/c1-5-6-7-8-9-16-29(25(32)28-22-15-12-20(27)17-23(22)33-4)18-19-10-13-21(14-11-19)34-26(2,3)24(30)31/h10-15,17H,5-9,16,18H2,1-4H3,(H,28,32)(H,30,31)