phenyl (E)-3-[1-[(4-bromophenyl)methyl]benzimidazol-2-yl]-2-phenyl-prop-2-enoate

Systemtic Name: phenyl (E)-3-[1-[(4-bromophenyl)methyl]benzimidazol-2-yl]-2-phenyl-prop-2-enoate Openeye Name: phenyl (E)-3-[1-[(4-bromophenyl)methyl]benzimidazol-2-yl]-2-phenyl-prop-2-enoate CAS Name: (E)-3-[1-[(4-bromophenyl)methyl]-2-benzimidazolyl]-2-phenyl-2-propenoic acid phenyl ester IUPAC Name: phenyl (E)-3-[1-[(4-bromophenyl)methyl]benzimidazol-2-yl]-2-phenylprop-2-enoate Traditional Name: (E)-3-[1-(4-bromobenzyl)benzimidazol-2-yl]-2-phenyl-acrylic acid phenyl ester Formula: C29H21BrN2O2 MolecularWeight: 509.39324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=CC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)Br)C(=O)OC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)/C(=C\C2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)Br)/C(=O)OC5=CC=CC=C5

InChI

InChI=1S/C29H21BrN2O2/c30-23-17-15-21(16-18-23)20-32-27-14-8-7-13-26(27)31-28(32)19-25(22-9-3-1-4-10-22)29(33)34-24-11-5-2-6-12-24/h1-19H,20H2/b25-19+