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

Systemtic Name: N4-[(4-methoxy-3-nitro-phenyl)methyl]-N4-(phenylmethyl)cyclohexane-1,4-diamine Openeye Name: N4-benzyl-N4-[(4-methoxy-3-nitro-phenyl)methyl]cyclohexane-1,4-diamine CAS Name: N4-[(4-methoxy-3-nitrophenyl)methyl]-N4-(phenylmethyl)cyclohexane-1,4-diamine IUPAC Name: 4-N-benzyl-4-N-[(4-methoxy-3-nitrophenyl)methyl]cyclohexane-1,4-diamine Traditional Name: (4-aminocyclohexyl)-benzyl-(4-methoxy-3-nitro-benzyl)amine Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CC2=CC=CC=C2)C3CCC(CC3)N)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CC2=CC=CC=C2)C3CCC(CC3)N)[N+](=O)[O-]

InChI

InChI=1S/C21H27N3O3/c1-27-21-12-7-17(13-20(21)24(25)26)15-23(14-16-5-3-2-4-6-16)19-10-8-18(22)9-11-19/h2-7,12-13,18-19H,8-11,14-15,22H2,1H3