N-(2-azanylcyclohexyl)-4-bromanyl-benzamide; methanesulfonic acid

Systemtic Name: N-(2-azanylcyclohexyl)-4-bromanyl-benzamide; methanesulfonic acid Openeye Name: N-(2-aminocyclohexyl)-4-bromo-benzamide; methanesulfonic acid CAS Name: N-(2-aminocyclohexyl)-4-bromobenzamide; methanesulfonic acid IUPAC Name: N-(2-aminocyclohexyl)-4-bromobenzamide; methanesulfonic acid Traditional Name: N-(2-aminocyclohexyl)-4-bromo-benzamide; mesylic acid Formula: C14H21BrN2O4S MolecularWeight: 393.29654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17BrN2O.CH4O3S/c14-10-7-5-9(6-8-10)13(17)16-12-4-2-1-3-11(12)15;1-5(2,3)4/h5-8,11-12H,1-4,15H2,(H,16,17);1H3,(H,2,3,4)