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

Systemtic Name: N-(4-methoxyphenyl)-N'-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]benzenecarboximidamide dihydrobromide Openeye Name: N-(4-methoxyphenyl)-N'-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]benzamidine dihydrobromide CAS Name: N-(4-methoxyphenyl)-N'-[4-[3-(1-pyrrolidinyl)propoxy]phenyl]benzenecarboximidamide dihydrobromide IUPAC Name: N-(4-methoxyphenyl)-N'-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]benzenecarboximidamide dihydrobromide Traditional Name: N-(4-methoxyphenyl)-N'-[4-(3-pyrrolidinopropoxy)phenyl]benzamidine dihydrobromide Formula: C27H33Br2N3O2 MolecularWeight: 591.37782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)OCCCN3CCCC3)C4=CC=CC=C4.Br.Br

Isomeric SMILES

COC1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)OCCCN3CCCC3)C4=CC=CC=C4.Br.Br

InChI

InChI=1S/C27H31N3O2.2BrH/c1-31-25-14-10-23(11-15-25)28-27(22-8-3-2-4-9-22)29-24-12-16-26(17-13-24)32-21-7-20-30-18-5-6-19-30;;/h2-4,8-17H,5-7,18-21H2,1H3,(H,28,29);2*1H