1-[3-(aminomethyl)-4-[(phenylmethyl)amino]phenyl]-2-ethyl-guanidine trihydrochloride

Systemtic Name: 1-[3-(aminomethyl)-4-[(phenylmethyl)amino]phenyl]-2-ethyl-guanidine trihydrochloride Openeye Name: 1-[3-(aminomethyl)-4-(benzylamino)phenyl]-2-ethyl-guanidine trihydrochloride CAS Name: 1-[3-(aminomethyl)-4-[(phenylmethyl)amino]phenyl]-2-ethylguanidine trihydrochloride IUPAC Name: 1-[3-(aminomethyl)-4-(benzylamino)phenyl]-2-ethylguanidine trihydrochloride Traditional Name: 1-[3-(aminomethyl)-4-(benzylamino)phenyl]-2-ethyl-guanidine trihydrochloride Formula: C17H26Cl3N5 MolecularWeight: 406.78084

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(N)NC1=CC(=C(C=C1)NCC2=CC=CC=C2)CN.Cl.Cl.Cl

Isomeric SMILES

CCN=C(N)NC1=CC(=C(C=C1)NCC2=CC=CC=C2)CN.Cl.Cl.Cl

InChI

InChI=1S/C17H23N5.3ClH/c1-2-20-17(19)22-15-8-9-16(14(10-15)11-18)21-12-13-6-4-3-5-7-13;;;/h3-10,21H,2,11-12,18H2,1H3,(H3,19,20,22);3*1H