3-azanyl-N'-[(E)-2-(4-nitrophenyl)ethenyl]benzenecarboximidamide hydrate dihydrochloride

Systemtic Name: 3-azanyl-N'-[(E)-2-(4-nitrophenyl)ethenyl]benzenecarboximidamide hydrate dihydrochloride Openeye Name: 3-amino-N'-[(E)-2-(4-nitrophenyl)vinyl]benzamidine hydrate dihydrochloride CAS Name: 3-amino-N'-[(E)-2-(4-nitrophenyl)ethenyl]benzenecarboximidamide hydrate dihydrochloride IUPAC Name: 3-amino-N'-[(E)-2-(4-nitrophenyl)ethenyl]benzenecarboximidamide hydrate dihydrochloride Traditional Name: 3-amino-N'-[(E)-2-(4-nitrophenyl)vinyl]benzamidine hydrate dihydrochloride Formula: C15H18Cl2N4O3 MolecularWeight: 373.23442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)C(=NC=CC2=CC=C(C=C2)[N+](=O)[O-])N.O.Cl.Cl

Isomeric SMILES

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

InChI

InChI=1S/C15H14N4O2.2ClH.H2O/c16-13-3-1-2-12(10-13)15(17)18-9-8-11-4-6-14(7-5-11)19(20)21;;;/h1-10H,16H2,(H2,17,18);2*1H;1H2/b9-8+;;;