2-[3-[3-methylbutanoyl-(phenylmethyl)amino]phenyl]ethanoic acid

Systemtic Name: 2-[3-[3-methylbutanoyl-(phenylmethyl)amino]phenyl]ethanoic acid Openeye Name: 2-[3-[benzyl(3-methylbutanoyl)amino]phenyl]acetic acid CAS Name: 2-[3-[(3-methyl-1-oxobutyl)-(phenylmethyl)amino]phenyl]acetic acid IUPAC Name: 2-[3-[benzyl(3-methylbutanoyl)amino]phenyl]acetic acid Traditional Name: 2-[3-[benzyl(isovaleryl)amino]phenyl]acetic acid Formula: C20H23NO3 MolecularWeight: 325.40152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N(CC1=CC=CC=C1)C2=CC=CC(=C2)CC(=O)O

Isomeric SMILES

CC(C)CC(=O)N(CC1=CC=CC=C1)C2=CC=CC(=C2)CC(=O)O

InChI

InChI=1S/C20H23NO3/c1-15(2)11-19(22)21(14-16-7-4-3-5-8-16)18-10-6-9-17(12-18)13-20(23)24/h3-10,12,15H,11,13-14H2,1-2H3,(H,23,24)