N-(2-bromophenyl)-4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxamide; (E)-but-2-enedioic acid

Systemtic Name: N-(2-bromophenyl)-4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxamide; (E)-but-2-enedioic acid Openeye Name: N-(2-bromophenyl)-4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxamide; fumaric acid CAS Name: N-(2-bromophenyl)-4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxamide; (E)-2-butenedioic acid IUPAC Name: N-(2-bromophenyl)-4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxamide; (E)-but-2-enedioic acid Traditional Name: N-(2-bromophenyl)-4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxamide; fumaric acid Formula: C18H18BrN3O5 MolecularWeight: 436.25662

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1C(=O)NC3=CC=CC=C3Br)NC=N2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CC2=C(CC1C(=O)NC3=CC=CC=C3Br)NC=N2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C14H14BrN3O.C4H4O4/c15-10-3-1-2-4-11(10)18-14(19)9-5-6-12-13(7-9)17-8-16-12;5-3(6)1-2-4(7)8/h1-4,8-9H,5-7H2,(H,16,17)(H,18,19);1-2H,(H,5,6)(H,7,8)/b;2-1+