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

Systemtic Name: 5-[4-[2-[methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]phenyl]-4-phenyl-pentanoic acid Openeye Name: 5-[4-[2-[benzyl(methyl)amino]-2-oxo-ethyl]phenyl]-4-phenyl-pentanoic acid CAS Name: 5-[4-[2-[methyl-(phenylmethyl)amino]-2-oxoethyl]phenyl]-4-phenylpentanoic acid IUPAC Name: 5-[4-[2-[benzyl(methyl)amino]-2-oxoethyl]phenyl]-4-phenylpentanoic acid Traditional Name: 5-[4-[2-[benzyl(methyl)amino]-2-keto-ethyl]phenyl]-4-phenyl-valeric acid Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)CC2=CC=C(C=C2)CC(CCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)CC2=CC=C(C=C2)CC(CCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C27H29NO3/c1-28(20-23-8-4-2-5-9-23)26(29)19-22-14-12-21(13-15-22)18-25(16-17-27(30)31)24-10-6-3-7-11-24/h2-15,25H,16-20H2,1H3,(H,30,31)