(Z)-but-2-enedioic acid; ethyl 4-(1H-benzimidazol-4-yl)piperazine-1-carboxylate

Systemtic Name: (Z)-but-2-enedioic acid; ethyl 4-(1H-benzimidazol-4-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-(1H-benzimidazol-4-yl)piperazine-1-carboxylate; maleic acid CAS Name: 4-(1H-benzimidazol-4-yl)-1-piperazinecarboxylic acid ethyl ester; (Z)-2-butenedioic acid IUPAC Name: (Z)-but-2-enedioic acid; ethyl 4-(1H-benzimidazol-4-yl)piperazine-1-carboxylate Traditional Name: 4-(1H-benzimidazol-4-yl)piperazine-1-carboxylic acid ethyl ester; maleic acid Formula: C18H22N4O6 MolecularWeight: 390.39048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=CC=CC3=C2N=CN3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=CC=CC3=C2N=CN3.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C14H18N4O2.C4H4O4/c1-2-20-14(19)18-8-6-17(7-9-18)12-5-3-4-11-13(12)16-10-15-11;5-3(6)1-2-4(7)8/h3-5,10H,2,6-9H2,1H3,(H,15,16);1-2H,(H,5,6)(H,7,8)/b;2-1-