3-[4-[1-[methyl(phenethyl)amino]-1-oxidanylidene-propan-2-yl]phenyl]-2-phenyl-propanoic acid

Systemtic Name: 3-[4-[1-[methyl(phenethyl)amino]-1-oxidanylidene-propan-2-yl]phenyl]-2-phenyl-propanoic acid Openeye Name: 3-[4-[1-methyl-2-[methyl(phenethyl)amino]-2-oxo-ethyl]phenyl]-2-phenyl-propanoic acid CAS Name: 3-[4-[1-[methyl(phenethyl)amino]-1-oxopropan-2-yl]phenyl]-2-phenylpropanoic acid IUPAC Name: 3-[4-[1-[methyl(phenethyl)amino]-1-oxopropan-2-yl]phenyl]-2-phenylpropanoic acid Traditional Name: 3-[4-[2-keto-1-methyl-2-[methyl(phenethyl)amino]ethyl]phenyl]-2-phenyl-propionic acid Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)CC(C2=CC=CC=C2)C(=O)O)C(=O)N(C)CCC3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=C(C=C1)CC(C2=CC=CC=C2)C(=O)O)C(=O)N(C)CCC3=CC=CC=C3

InChI

InChI=1S/C27H29NO3/c1-20(26(29)28(2)18-17-21-9-5-3-6-10-21)23-15-13-22(14-16-23)19-25(27(30)31)24-11-7-4-8-12-24/h3-16,20,25H,17-19H2,1-2H3,(H,30,31)