3-chloranyl-4-[(2R)-4-[(1R)-1-(4-cyanophenyl)ethyl]-2-phenyl-piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-[(2R)-4-[(1R)-1-(4-cyanophenyl)ethyl]-2-phenyl-piperazin-1-yl]benzenecarbonitrile Openeye Name: 3-chloro-4-[(2R)-4-[(1R)-1-(4-cyanophenyl)ethyl]-2-phenyl-piperazin-1-yl]benzonitrile CAS Name: 3-chloro-4-[(2R)-4-[(1R)-1-(4-cyanophenyl)ethyl]-2-phenyl-1-piperazinyl]benzonitrile IUPAC Name: 3-chloro-4-[(2R)-4-[(1R)-1-(4-cyanophenyl)ethyl]-2-phenylpiperazin-1-yl]benzonitrile Traditional Name: 3-chloro-4-[(2R)-4-[(1R)-1-(4-cyanophenyl)ethyl]-2-phenyl-piperazino]benzonitrile Formula: C26H23ClN4 MolecularWeight: 426.94062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C#N)N2CCN(C(C2)C3=CC=CC=C3)C4=C(C=C(C=C4)C#N)Cl

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)C#N)N2CCN([C@@H](C2)C3=CC=CC=C3)C4=C(C=C(C=C4)C#N)Cl

InChI

InChI=1S/C26H23ClN4/c1-19(22-10-7-20(16-28)8-11-22)30-13-14-31(25-12-9-21(17-29)15-24(25)27)26(18-30)23-5-3-2-4-6-23/h2-12,15,19,26H,13-14,18H2,1H3/t19-,26+/m1/s1