ethyl 4-[4-(3H-benzimidazol-5-ylcarbonyl)piperazin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[4-(3H-benzimidazol-5-ylcarbonyl)piperazin-1-yl]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[4-(3H-benzimidazole-5-carbonyl)piperazin-1-yl]-4-oxo-butanoate CAS Name: 4-[4-[3H-benzimidazol-5-yl(oxo)methyl]-1-piperazinyl]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[4-(3H-benzimidazole-5-carbonyl)piperazin-1-yl]-4-oxobutanoate Traditional Name: 4-[4-(3H-benzimidazole-5-carbonyl)piperazino]-4-keto-butyric acid ethyl ester Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)N=CN3

Isomeric SMILES

CCOC(=O)CCC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)N=CN3

InChI

InChI=1S/C18H22N4O4/c1-2-26-17(24)6-5-16(23)21-7-9-22(10-8-21)18(25)13-3-4-14-15(11-13)20-12-19-14/h3-4,11-12H,2,5-10H2,1H3,(H,19,20)