(3R)-4-(1H-benzimidazol-2-yl)-3-[2-(phenylcarbonyloxy)phenyl]butanoate

Systemtic Name: (3R)-4-(1H-benzimidazol-2-yl)-3-[2-(phenylcarbonyloxy)phenyl]butanoate Openeye Name: (3R)-4-(1H-benzimidazol-2-yl)-3-(2-benzoyloxyphenyl)butanoate CAS Name: (3R)-4-(1H-benzimidazol-2-yl)-3-(2-benzoyloxyphenyl)butanoate IUPAC Name: (3R)-4-(1H-benzimidazol-2-yl)-3-(2-benzoyloxyphenyl)butanoate Traditional Name: (3R)-4-(1H-benzimidazol-2-yl)-3-(2-benzoyloxyphenyl)butyrate Formula: C24H19N2O4- MolecularWeight: 399.41866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C(CC3=NC4=CC=CC=C4N3)CC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2[C@H](CC3=NC4=CC=CC=C4N3)CC(=O)[O-]

InChI

InChI=1S/C24H20N2O4/c27-23(28)15-17(14-22-25-19-11-5-6-12-20(19)26-22)18-10-4-7-13-21(18)30-24(29)16-8-2-1-3-9-16/h1-13,17H,14-15H2,(H,25,26)(H,27,28)/p-1/t17-/m1/s1