3-[[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 3-[[4-[(4-tert-butylphenyl)methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 3-[[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 3-[[4-(4-tert-butylbenzyl)piperazino]methyl]benzonitrile Formula: C23H29N3 MolecularWeight: 347.49646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)CC3=CC=CC(=C3)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)CC3=CC=CC(=C3)C#N

InChI

InChI=1S/C23H29N3/c1-23(2,3)22-9-7-19(8-10-22)17-25-11-13-26(14-12-25)18-21-6-4-5-20(15-21)16-24/h4-10,15H,11-14,17-18H2,1-3H3