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

Systemtic Name: ethyl 1-[3-[4-(2-methoxy-2-oxidanylidene-ethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate Openeye Name: ethyl 1-[3-[4-(2-methoxy-2-oxo-ethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate CAS Name: 1-[3-[4-(2-methoxy-2-oxoethyl)-1-piperazinyl]phenyl]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[4-(2-methoxy-2-oxoethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate Traditional Name: 1-[3-[4-(2-keto-2-methoxy-ethyl)piperazino]phenyl]benzimidazole-5-carboxylic acid ethyl ester Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC(=CC=C3)N4CCN(CC4)CC(=O)OC

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC(=CC=C3)N4CCN(CC4)CC(=O)OC

InChI

InChI=1S/C23H26N4O4/c1-3-31-23(29)17-7-8-21-20(13-17)24-16-27(21)19-6-4-5-18(14-19)26-11-9-25(10-12-26)15-22(28)30-2/h4-8,13-14,16H,3,9-12,15H2,1-2H3