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

Systemtic Name: 2-methoxyethyl 1-[3-[4-(2-azanyl-2-oxidanylidene-ethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate Openeye Name: 2-methoxyethyl 1-[3-[4-(2-amino-2-oxo-ethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate CAS Name: 1-[3-[4-(2-amino-2-oxoethyl)-1-piperazinyl]phenyl]-5-benzimidazolecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 1-[3-[4-(2-amino-2-oxoethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate Traditional Name: 1-[3-[4-(2-amino-2-keto-ethyl)piperazino]phenyl]benzimidazole-5-carboxylic acid 2-methoxyethyl ester Formula: C23H27N5O4 MolecularWeight: 437.49158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N5O4/c1-31-11-12-32-23(30)17-5-6-21-20(13-17)25-16-28(21)19-4-2-3-18(14-19)27-9-7-26(8-10-27)15-22(24)29/h2-6,13-14,16H,7-12,15H2,1H3,(H2,24,29)