4-[4-[4-[(E)-2-[4-(2,4-dichlorophenyl)-1-[2-(1-naphthalen-1-ylethylamino)-2-oxidanylidene-ethyl]imidazol-2-yl]ethenyl]phenyl]phenoxy]butanoic acid

Systemtic Name: 4-[4-[4-[(E)-2-[4-(2,4-dichlorophenyl)-1-[2-(1-naphthalen-1-ylethylamino)-2-oxidanylidene-ethyl]imidazol-2-yl]ethenyl]phenyl]phenoxy]butanoic acid Openeye Name: 4-[4-[4-[(E)-2-[4-(2,4-dichlorophenyl)-1-[2-[1-(1-naphthyl)ethylamino]-2-oxo-ethyl]imidazol-2-yl]vinyl]phenyl]phenoxy]butanoic acid CAS Name: 4-[4-[4-[(E)-2-[4-(2,4-dichlorophenyl)-1-[2-[1-(1-naphthalenyl)ethylamino]-2-oxoethyl]-2-imidazolyl]ethenyl]phenyl]phenoxy]butanoic acid IUPAC Name: 4-[4-[4-[(E)-2-[4-(2,4-dichlorophenyl)-1-[2-(1-naphthalen-1-ylethylamino)-2-oxoethyl]imidazol-2-yl]ethenyl]phenyl]phenoxy]butanoic acid Traditional Name: 4-[4-[4-[(E)-2-[4-(2,4-dichlorophenyl)-1-[2-keto-2-[1-(1-naphthyl)ethylamino]ethyl]imidazol-2-yl]vinyl]phenyl]phenoxy]butyric acid Formula: C41H35Cl2N3O4 MolecularWeight: 704.6403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)CN3C=C(N=C3C=CC4=CC=C(C=C4)C5=CC=C(C=C5)OCCCC(=O)O)C6=C(C=C(C=C6)Cl)Cl

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)CN3C=C(N=C3/C=C/C4=CC=C(C=C4)C5=CC=C(C=C5)OCCCC(=O)O)C6=C(C=C(C=C6)Cl)Cl

InChI

InChI=1S/C41H35Cl2N3O4/c1-27(34-9-4-7-31-6-2-3-8-35(31)34)44-40(47)26-46-25-38(36-21-18-32(42)24-37(36)43)45-39(46)22-13-28-11-14-29(15-12-28)30-16-19-33(20-17-30)50-23-5-10-41(48)49/h2-4,6-9,11-22,24-25,27H,5,10,23,26H2,1H3,(H,44,47)(H,48,49)/b22-13+