(E)-5-[4-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]phenyl]-4-phenyl-pent-2-enoic acid

Systemtic Name: (E)-5-[4-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]phenyl]-4-phenyl-pent-2-enoic acid Openeye Name: (E)-5-[4-[2-[methyl(phenethyl)amino]-2-oxo-ethyl]phenyl]-4-phenyl-pent-2-enoic acid CAS Name: (E)-5-[4-[2-[methyl(phenethyl)amino]-2-oxoethyl]phenyl]-4-phenyl-2-pentenoic acid IUPAC Name: (E)-5-[4-[2-[methyl(phenethyl)amino]-2-oxoethyl]phenyl]-4-phenylpent-2-enoic acid Traditional Name: (E)-5-[4-[2-keto-2-[methyl(phenethyl)amino]ethyl]phenyl]-4-phenyl-pent-2-enoic acid Formula: C28H29NO3 MolecularWeight: 427.53476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29NO3/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/h2-17,26H,18-21H2,1H3,(H,31,32)/b17-16+