N-(2-azanylcyclohexyl)-4-bromanyl-benzamide; (E)-but-2-enedioic acid

Systemtic Name: N-(2-azanylcyclohexyl)-4-bromanyl-benzamide; (E)-but-2-enedioic acid Openeye Name: N-(2-aminocyclohexyl)-4-bromo-benzamide; fumaric acid CAS Name: N-(2-aminocyclohexyl)-4-bromobenzamide; (E)-2-butenedioic acid IUPAC Name: N-(2-aminocyclohexyl)-4-bromobenzamide; (E)-but-2-enedioic acid Traditional Name: N-(2-aminocyclohexyl)-4-bromo-benzamide; fumaric acid Formula: C17H21BrN2O5 MolecularWeight: 413.26304

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)NC(=O)C2=CC=C(C=C2)Br.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CCC(C(C1)N)NC(=O)C2=CC=C(C=C2)Br.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C13H17BrN2O.C4H4O4/c14-10-7-5-9(6-8-10)13(17)16-12-4-2-1-3-11(12)15;5-3(6)1-2-4(7)8/h5-8,11-12H,1-4,15H2,(H,16,17);1-2H,(H,5,6)(H,7,8)/b;2-1+