N-(4-methoxyphenyl)-4-methyl-N'-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]benzenecarboximidamide bromide

Systemtic Name: N-(4-methoxyphenyl)-4-methyl-N'-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]benzenecarboximidamide bromide Openeye Name: N-(4-methoxyphenyl)-4-methyl-N'-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]benzamidine bromide CAS Name: N-(4-methoxyphenyl)-4-methyl-N'-[4-[3-(1-pyrrolidinyl)propoxy]phenyl]benzenecarboximidamide bromide IUPAC Name: N-(4-methoxyphenyl)-4-methyl-N'-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]benzenecarboximidamide bromide Traditional Name: N-(4-methoxyphenyl)-4-methyl-N'-[4-(3-pyrrolidinopropoxy)phenyl]benzamidine bromide Formula: C28H33BrN3O2- MolecularWeight: 523.48452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=NC2=CC=C(C=C2)OCCCN3CCCC3)NC4=CC=C(C=C4)OC.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=NC2=CC=C(C=C2)OCCCN3CCCC3)NC4=CC=C(C=C4)OC.[Br-]

InChI

InChI=1S/C28H33N3O2.BrH/c1-22-6-8-23(9-7-22)28(29-24-10-14-26(32-2)15-11-24)30-25-12-16-27(17-13-25)33-21-5-20-31-18-3-4-19-31;/h6-17H,3-5,18-21H2,1-2H3,(H,29,30);1H/p-1