ethyl (E)-3-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]-4-phenyl-but-2-enoate

Systemtic Name: ethyl (E)-3-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]-4-phenyl-but-2-enoate Openeye Name: ethyl (E)-3-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]-4-phenyl-but-2-enoate CAS Name: (E)-3-[2-butyl-3-[(2-chlorophenyl)methyl]-4-imidazolyl]-4-phenyl-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]-4-phenylbut-2-enoate Traditional Name: (E)-3-[2-butyl-3-(2-chlorobenzyl)imidazol-4-yl]-4-phenyl-but-2-enoic acid ethyl ester Formula: C26H29ClN2O2 MolecularWeight: 436.97366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)C(=CC(=O)OCC)CC3=CC=CC=C3

Isomeric SMILES

CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)/C(=C/C(=O)OCC)/CC3=CC=CC=C3

InChI

InChI=1S/C26H29ClN2O2/c1-3-5-15-25-28-18-24(29(25)19-21-13-9-10-14-23(21)27)22(17-26(30)31-4-2)16-20-11-7-6-8-12-20/h6-14,17-18H,3-5,15-16,19H2,1-2H3/b22-17+