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

Systemtic Name: N4-[(4-methoxy-3-nitro-phenyl)methyl]-N4-(pyridin-3-ylmethyl)cyclohexane-1,4-diamine Openeye Name: N4-[(4-methoxy-3-nitro-phenyl)methyl]-N4-(3-pyridylmethyl)cyclohexane-1,4-diamine CAS Name: N4-[(4-methoxy-3-nitrophenyl)methyl]-N4-(3-pyridinylmethyl)cyclohexane-1,4-diamine IUPAC Name: 4-N-[(4-methoxy-3-nitrophenyl)methyl]-4-N-(pyridin-3-ylmethyl)cyclohexane-1,4-diamine Traditional Name: (4-aminocyclohexyl)-(4-methoxy-3-nitro-benzyl)-(3-pyridylmethyl)amine Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O3/c1-27-20-9-4-15(11-19(20)24(25)26)13-23(14-16-3-2-10-22-12-16)18-7-5-17(21)6-8-18/h2-4,9-12,17-18H,5-8,13-14,21H2,1H3