2-(4-butoxyphenyl)-1-phenyl-1-(4-propan-2-yloxyphenyl)guanidine hydrochloride

Systemtic Name: 2-(4-butoxyphenyl)-1-phenyl-1-(4-propan-2-yloxyphenyl)guanidine hydrochloride Openeye Name: 2-(4-butoxyphenyl)-1-(4-isopropoxyphenyl)-1-phenyl-guanidine hydrochloride CAS Name: 2-(4-butoxyphenyl)-1-phenyl-1-(4-propan-2-yloxyphenyl)guanidine hydrochloride IUPAC Name: 2-(4-butoxyphenyl)-1-phenyl-1-(4-propan-2-yloxyphenyl)guanidine hydrochloride Traditional Name: 2-(4-butoxyphenyl)-1-(4-isopropoxyphenyl)-1-phenyl-guanidine hydrochloride Formula: C26H32ClN3O2 MolecularWeight: 454.00418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N=C(N)N(C2=CC=CC=C2)C3=CC=C(C=C3)OC(C)C.Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N=C(N)N(C2=CC=CC=C2)C3=CC=C(C=C3)OC(C)C.Cl

InChI

InChI=1S/C26H31N3O2.ClH/c1-4-5-19-30-24-15-11-21(12-16-24)28-26(27)29(22-9-7-6-8-10-22)23-13-17-25(18-14-23)31-20(2)3;/h6-18,20H,4-5,19H2,1-3H3,(H2,27,28);1H