4-(4-bromanyl-2-chloranyl-phenyl)piperidine-4-carbonitrile hydrochloride

Systemtic Name: 4-(4-bromanyl-2-chloranyl-phenyl)piperidine-4-carbonitrile hydrochloride Openeye Name: 4-(4-bromo-2-chloro-phenyl)piperidine-4-carbonitrile hydrochloride CAS Name: 4-(4-bromo-2-chlorophenyl)-4-piperidinecarbonitrile hydrochloride IUPAC Name: 4-(4-bromo-2-chlorophenyl)piperidine-4-carbonitrile hydrochloride Traditional Name: 4-(4-bromo-2-chloro-phenyl)isonipecotonitrile hydrochloride Formula: C12H13BrCl2N2 MolecularWeight: 336.05502

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1(C#N)C2=C(C=C(C=C2)Br)Cl.Cl

Isomeric SMILES

C1CNCCC1(C#N)C2=C(C=C(C=C2)Br)Cl.Cl

InChI

InChI=1S/C12H12BrClN2.ClH/c13-9-1-2-10(11(14)7-9)12(8-15)3-5-16-6-4-12;/h1-2,7,16H,3-6H2;1H