2-(1-hydroxyethyl)-1-[3-[4-(2-methoxy-2-oxidanylidene-ethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate

Systemtic Name: 2-(1-hydroxyethyl)-1-[3-[4-(2-methoxy-2-oxidanylidene-ethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate Openeye Name: 2-(1-hydroxyethyl)-1-[3-[4-(2-methoxy-2-oxo-ethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate CAS Name: 2-(1-hydroxyethyl)-1-[3-[4-(2-methoxy-2-oxoethyl)-1-piperazinyl]phenyl]-5-benzimidazolecarboxylate IUPAC Name: 2-(1-hydroxyethyl)-1-[3-[4-(2-methoxy-2-oxoethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate Traditional Name: 2-(1-hydroxyethyl)-1-[3-[4-(2-keto-2-methoxy-ethyl)piperazino]phenyl]benzimidazole-5-carboxylate Formula: C23H25N4O5- MolecularWeight: 437.4684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=C(N1C3=CC(=CC=C3)N4CCN(CC4)CC(=O)OC)C=CC(=C2)C(=O)[O-])O

Isomeric SMILES

CC(C1=NC2=C(N1C3=CC(=CC=C3)N4CCN(CC4)CC(=O)OC)C=CC(=C2)C(=O)[O-])O

InChI

InChI=1S/C23H26N4O5/c1-15(28)22-24-19-12-16(23(30)31)6-7-20(19)27(22)18-5-3-4-17(13-18)26-10-8-25(9-11-26)14-21(29)32-2/h3-7,12-13,15,28H,8-11,14H2,1-2H3,(H,30,31)/p-1