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

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

Systemtic Name:3-[4-[3-[methyl(octylcarbamoyl)amino]phenyl]phenyl]propanoic acid
Openeye Name:3-[4-[3-[methyl(octylcarbamoyl)amino]phenyl]phenyl]propanoic acid
CAS Name:3-[4-[3-[methyl-[(octylamino)-oxomethyl]amino]phenyl]phenyl]propanoic acid
IUPAC Name:3-[4-[3-[methyl(octylcarbamoyl)amino]phenyl]phenyl]propanoic acid
Traditional Name:3-[4-[3-[methyl(octylcarbamoyl)amino]phenyl]phenyl]propionic acid
Formula: C25H34N2O3
MolecularWeight: 410.54906
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C25H34N2O3/c1-3-4-5-6-7-8-18-26-25(30)27(2)23-11-9-10-22(19-23)21-15-12-20(13-16-21)14-17-24(28)29/h9-13,15-16,19H,3-8,14,17-18H2,1-2H3,(H,26,30)(H,28,29)


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