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

Systemtic Name: 3-[3-methyl-4-[3-[methyl(pentylcarbamoyl)amino]phenyl]phenyl]propanoic acid Openeye Name: 3-[3-methyl-4-[3-[methyl(pentylcarbamoyl)amino]phenyl]phenyl]propanoic acid CAS Name: 3-[3-methyl-4-[3-[methyl-[oxo-(pentylamino)methyl]amino]phenyl]phenyl]propanoic acid IUPAC Name: 3-[3-methyl-4-[3-[methyl(pentylcarbamoyl)amino]phenyl]phenyl]propanoic acid Traditional Name: 3-[4-[3-[amylcarbamoyl(methyl)amino]phenyl]-3-methyl-phenyl]propionic acid Formula: C23H30N2O3 MolecularWeight: 382.4959

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O3/c1-4-5-6-14-24-23(28)25(3)20-9-7-8-19(16-20)21-12-10-18(15-17(21)2)11-13-22(26)27/h7-10,12,15-16H,4-6,11,13-14H2,1-3H3,(H,24,28)(H,26,27)