N4-[(4-tert-butylphenyl)methyl]-N4-[(4-methoxy-3-nitro-phenyl)methyl]cyclohexane-1,4-diamine

Systemtic Name: N4-[(4-tert-butylphenyl)methyl]-N4-[(4-methoxy-3-nitro-phenyl)methyl]cyclohexane-1,4-diamine Openeye Name: N4-[(4-tert-butylphenyl)methyl]-N4-[(4-methoxy-3-nitro-phenyl)methyl]cyclohexane-1,4-diamine CAS Name: N4-[(4-tert-butylphenyl)methyl]-N4-[(4-methoxy-3-nitrophenyl)methyl]cyclohexane-1,4-diamine IUPAC Name: 4-N-[(4-tert-butylphenyl)methyl]-4-N-[(4-methoxy-3-nitrophenyl)methyl]cyclohexane-1,4-diamine Traditional Name: (4-aminocyclohexyl)-(4-tert-butylbenzyl)-(4-methoxy-3-nitro-benzyl)amine Formula: C25H35N3O3 MolecularWeight: 425.5637

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC(=C(C=C2)OC)[N+](=O)[O-])C3CCC(CC3)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC(=C(C=C2)OC)[N+](=O)[O-])C3CCC(CC3)N

InChI

InChI=1S/C25H35N3O3/c1-25(2,3)20-8-5-18(6-9-20)16-27(22-12-10-21(26)11-13-22)17-19-7-14-24(31-4)23(15-19)28(29)30/h5-9,14-15,21-22H,10-13,16-17,26H2,1-4H3