3-[4-[3-[heptylcarbamoyl(methyl)amino]phenyl]-3-oxidanyl-phenyl]propanoic acid

Systemtic Name: 3-[4-[3-[heptylcarbamoyl(methyl)amino]phenyl]-3-oxidanyl-phenyl]propanoic acid Openeye Name: 3-[4-[3-[heptylcarbamoyl(methyl)amino]phenyl]-3-hydroxy-phenyl]propanoic acid CAS Name: 3-[4-[3-[[(heptylamino)-oxomethyl]-methylamino]phenyl]-3-hydroxyphenyl]propanoic acid IUPAC Name: 3-[4-[3-[heptylcarbamoyl(methyl)amino]phenyl]-3-hydroxyphenyl]propanoic acid Traditional Name: 3-[4-[3-[heptylcarbamoyl(methyl)amino]phenyl]-3-hydroxy-phenyl]propionic acid Formula: C24H32N2O4 MolecularWeight: 412.52188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)N(C)C1=CC=CC(=C1)C2=C(C=C(C=C2)CCC(=O)O)O

Isomeric SMILES

CCCCCCCNC(=O)N(C)C1=CC=CC(=C1)C2=C(C=C(C=C2)CCC(=O)O)O

InChI

InChI=1S/C24H32N2O4/c1-3-4-5-6-7-15-25-24(30)26(2)20-10-8-9-19(17-20)21-13-11-18(16-22(21)27)12-14-23(28)29/h8-11,13,16-17,27H,3-7,12,14-15H2,1-2H3,(H,25,30)(H,28,29)