N'-[(E)-3-[(4-piperidin-4-yloxyphenyl)amino]prop-1-enyl]benzenecarboximidamide trihydrochloride

Systemtic Name: N'-[(E)-3-[(4-piperidin-4-yloxyphenyl)amino]prop-1-enyl]benzenecarboximidamide trihydrochloride Openeye Name: N'-[(E)-3-[4-(4-piperidyloxy)anilino]prop-1-enyl]benzamidine trihydrochloride CAS Name: N'-[(E)-3-[4-(4-piperidinyloxy)anilino]prop-1-enyl]benzenecarboximidamide trihydrochloride IUPAC Name: N'-[(E)-3-(4-piperidin-4-yloxyanilino)prop-1-enyl]benzenecarboximidamide trihydrochloride Traditional Name: N'-[(E)-3-[4-(4-piperidyloxy)anilino]prop-1-enyl]benzamidine trihydrochloride Formula: C21H29Cl3N4O MolecularWeight: 459.84016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1OC2=CC=C(C=C2)NCC=CN=C(C3=CC=CC=C3)N.Cl.Cl.Cl

Isomeric SMILES

C1CNCCC1OC2=CC=C(C=C2)NC/C=C/N=C(C3=CC=CC=C3)N.Cl.Cl.Cl

InChI

InChI=1S/C21H26N4O.3ClH/c22-21(17-5-2-1-3-6-17)25-14-4-13-24-18-7-9-19(10-8-18)26-20-11-15-23-16-12-20;;;/h1-10,14,20,23-24H,11-13,15-16H2,(H2,22,25);3*1H/b14-4+;;;