2-[(3-bromanyl-4-methoxy-phenyl)methyl]-1-(3-pyrrolidin-1-ylpropyl)guanidine dihydrochloride

Systemtic Name: 2-[(3-bromanyl-4-methoxy-phenyl)methyl]-1-(3-pyrrolidin-1-ylpropyl)guanidine dihydrochloride Openeye Name: 2-[(3-bromo-4-methoxy-phenyl)methyl]-1-(3-pyrrolidin-1-ylpropyl)guanidine dihydrochloride CAS Name: 2-[(3-bromo-4-methoxyphenyl)methyl]-1-[3-(1-pyrrolidinyl)propyl]guanidine dihydrochloride IUPAC Name: 2-[(3-bromo-4-methoxyphenyl)methyl]-1-(3-pyrrolidin-1-ylpropyl)guanidine dihydrochloride Traditional Name: 2-(3-bromo-4-methoxy-benzyl)-1-(3-pyrrolidinopropyl)guanidine dihydrochloride Formula: C16H27BrCl2N4O MolecularWeight: 442.22178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN=C(N)NCCCN2CCCC2)Br.Cl.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CN=C(N)NCCCN2CCCC2)Br.Cl.Cl

InChI

InChI=1S/C16H25BrN4O.2ClH/c1-22-15-6-5-13(11-14(15)17)12-20-16(18)19-7-4-10-21-8-2-3-9-21;;/h5-6,11H,2-4,7-10,12H2,1H3,(H3,18,19,20);2*1H