[4-[[(4-tert-butylphenyl)methyl-[(4-nitrophenyl)methyl]amino]methyl]phenyl]methanamine

Systemtic Name: [4-[[(4-tert-butylphenyl)methyl-[(4-nitrophenyl)methyl]amino]methyl]phenyl]methanamine Openeye Name: [4-[[(4-tert-butylphenyl)methyl-[(4-nitrophenyl)methyl]amino]methyl]phenyl]methanamine CAS Name: [4-[[(4-tert-butylphenyl)methyl-[(4-nitrophenyl)methyl]amino]methyl]phenyl]methanamine IUPAC Name: [4-[[(4-tert-butylphenyl)methyl-[(4-nitrophenyl)methyl]amino]methyl]phenyl]methanamine Traditional Name: [4-(aminomethyl)benzyl]-(4-tert-butylbenzyl)-(4-nitrobenzyl)amine Formula: C26H31N3O2 MolecularWeight: 417.54324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)CN)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)CN)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C26H31N3O2/c1-26(2,3)24-12-8-22(9-13-24)18-28(17-21-6-4-20(16-27)5-7-21)19-23-10-14-25(15-11-23)29(30)31/h4-15H,16-19,27H2,1-3H3