5-[4-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]phenyl]-4-phenyl-pentanoic acid

Systemtic Name: 5-[4-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]phenyl]-4-phenyl-pentanoic acid Openeye Name: 5-[4-[2-[methyl(phenethyl)amino]-2-oxo-ethyl]phenyl]-4-phenyl-pentanoic acid CAS Name: 5-[4-[2-[methyl(phenethyl)amino]-2-oxoethyl]phenyl]-4-phenylpentanoic acid IUPAC Name: 5-[4-[2-[methyl(phenethyl)amino]-2-oxoethyl]phenyl]-4-phenylpentanoic acid Traditional Name: 5-[4-[2-keto-2-[methyl(phenethyl)amino]ethyl]phenyl]-4-phenyl-valeric acid Formula: C28H31NO3 MolecularWeight: 429.55064

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C(=O)CC2=CC=C(C=C2)CC(CCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CN(CCC1=CC=CC=C1)C(=O)CC2=CC=C(C=C2)CC(CCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C28H31NO3/c1-29(19-18-22-8-4-2-5-9-22)27(30)21-24-14-12-23(13-15-24)20-26(16-17-28(31)32)25-10-6-3-7-11-25/h2-15,26H,16-21H2,1H3,(H,31,32)