4-[[3-azanylpropyl-[(4-tert-butylphenyl)methyl]amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[3-azanylpropyl-[(4-tert-butylphenyl)methyl]amino]methyl]benzenecarbonitrile Openeye Name: 4-[[3-aminopropyl-[(4-tert-butylphenyl)methyl]amino]methyl]benzonitrile CAS Name: 4-[[3-aminopropyl-[(4-tert-butylphenyl)methyl]amino]methyl]benzonitrile IUPAC Name: 4-[[3-aminopropyl-[(4-tert-butylphenyl)methyl]amino]methyl]benzonitrile Traditional Name: 4-[[3-aminopropyl-(4-tert-butylbenzyl)amino]methyl]benzonitrile Formula: C22H29N3 MolecularWeight: 335.48576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(CCCN)CC2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(CCCN)CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C22H29N3/c1-22(2,3)21-11-9-20(10-12-21)17-25(14-4-13-23)16-19-7-5-18(15-24)6-8-19/h5-12H,4,13-14,16-17,23H2,1-3H3