1-[(3-bromophenyl)amino]-N-(cyanomethyl)cyclohexane-1-carboxamide

Systemtic Name: 1-[(3-bromophenyl)amino]-N-(cyanomethyl)cyclohexane-1-carboxamide Openeye Name: 1-(3-bromoanilino)-N-(cyanomethyl)cyclohexanecarboxamide CAS Name: 1-(3-bromoanilino)-N-(cyanomethyl)-1-cyclohexanecarboxamide IUPAC Name: 1-(3-bromoanilino)-N-(cyanomethyl)cyclohexane-1-carboxamide Traditional Name: 1-(3-bromoanilino)-N-(cyanomethyl)cyclohexanecarboxamide Formula: C15H18BrN3O MolecularWeight: 336.22692

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NCC#N)NC2=CC(=CC=C2)Br

Isomeric SMILES

C1CCC(CC1)(C(=O)NCC#N)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C15H18BrN3O/c16-12-5-4-6-13(11-12)19-15(7-2-1-3-8-15)14(20)18-10-9-17/h4-6,11,19H,1-3,7-8,10H2,(H,18,20)