1,2,3-tris[(E)-(4-azanyl-2-methoxy-phenyl)methylideneamino]guanidine hydrochloride

Systemtic Name: 1,2,3-tris[(E)-(4-azanyl-2-methoxy-phenyl)methylideneamino]guanidine hydrochloride Openeye Name: 1,2,3-tris[(E)-(4-amino-2-methoxy-phenyl)methyleneamino]guanidine hydrochloride CAS Name: 1,2,3-tris[(E)-(4-amino-2-methoxyphenyl)methylideneamino]guanidine hydrochloride IUPAC Name: 1,2,3-tris[(E)-(4-amino-2-methoxyphenyl)methylideneamino]guanidine hydrochloride Traditional Name: 1,2,3-tris[(E)-(4-amino-2-methoxy-benzylidene)amino]guanidine hydrochloride Formula: C25H30ClN9O3 MolecularWeight: 540.0172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N)C=NNC(=NN=CC2=C(C=C(C=C2)N)OC)NN=CC3=C(C=C(C=C3)N)OC.Cl

Isomeric SMILES

COC1=C(C=CC(=C1)N)/C=N/NC(=N/N=C/C2=C(C=C(C=C2)N)OC)N/N=C/C3=C(C=C(C=C3)N)OC.Cl

InChI

InChI=1S/C25H29N9O3.ClH/c1-35-22-10-19(26)7-4-16(22)13-29-32-25(33-30-14-17-5-8-20(27)11-23(17)36-2)34-31-15-18-6-9-21(28)12-24(18)37-3;/h4-15H,26-28H2,1-3H3,(H2,32,33,34);1H/b29-13+,30-14+,31-15+;