1-[[(3-bromophenyl)amino]-cyano-methyl]cyclohexane-1-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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