4-[[[4-(aminomethyl)cyclohexyl]methyl-[(4-tert-butylphenyl)methyl]amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[[4-(aminomethyl)cyclohexyl]methyl-[(4-tert-butylphenyl)methyl]amino]methyl]benzenecarbonitrile Openeye Name: 4-[[[4-(aminomethyl)cyclohexyl]methyl-[(4-tert-butylphenyl)methyl]amino]methyl]benzonitrile CAS Name: 4-[[[4-(aminomethyl)cyclohexyl]methyl-[(4-tert-butylphenyl)methyl]amino]methyl]benzonitrile IUPAC Name: 4-[[[4-(aminomethyl)cyclohexyl]methyl-[(4-tert-butylphenyl)methyl]amino]methyl]benzonitrile Traditional Name: 4-[[[4-(aminomethyl)cyclohexyl]methyl-(4-tert-butylbenzyl)amino]methyl]benzonitrile Formula: C27H37N3 MolecularWeight: 403.60278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(CC2CCC(CC2)CN)CC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(CC2CCC(CC2)CN)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C27H37N3/c1-27(2,3)26-14-12-25(13-15-26)20-30(18-23-8-4-21(16-28)5-9-23)19-24-10-6-22(17-29)7-11-24/h4-5,8-9,12-15,22,24H,6-7,10-11,17-20,29H2,1-3H3