4-[[4-(aminomethyl)-2-nitro-phenyl]methoxy]-N'-methyl-benzenecarboximidamide dihydrochloride

Systemtic Name: 4-[[4-(aminomethyl)-2-nitro-phenyl]methoxy]-N'-methyl-benzenecarboximidamide dihydrochloride Openeye Name: 4-[[4-(aminomethyl)-2-nitro-phenyl]methoxy]-N'-methyl-benzamidine dihydrochloride CAS Name: 4-[[4-(aminomethyl)-2-nitrophenyl]methoxy]-N'-methylbenzenecarboximidamide dihydrochloride IUPAC Name: 4-[[4-(aminomethyl)-2-nitrophenyl]methoxy]-N'-methylbenzenecarboximidamide dihydrochloride Traditional Name: 4-[4-(aminomethyl)-2-nitro-benzyl]oxy-N'-methyl-benzamidine dihydrochloride Formula: C16H20Cl2N4O3 MolecularWeight: 387.261

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(C1=CC=C(C=C1)OCC2=C(C=C(C=C2)CN)[N+](=O)[O-])N.Cl.Cl

Isomeric SMILES

CN=C(C1=CC=C(C=C1)OCC2=C(C=C(C=C2)CN)[N+](=O)[O-])N.Cl.Cl

InChI

InChI=1S/C16H18N4O3.2ClH/c1-19-16(18)12-4-6-14(7-5-12)23-10-13-3-2-11(9-17)8-15(13)20(21)22;;/h2-8H,9-10,17H2,1H3,(H2,18,19);2*1H