3-(ethoxymethyl)-N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-(ethoxymethyl)-N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-3-(ethoxymethyl)benzofuran-2-carboxamide CAS Name: 3-(ethoxymethyl)-N-[4-[4-(phenylmethyl)-1-piperazin-4-iumyl]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-3-(ethoxymethyl)-1-benzofuran-2-carboxamide Traditional Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-3-(ethoxymethyl)coumarilamide Formula: C29H32N3O3+ MolecularWeight: 470.58268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(OC2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)N4CC[NH+](CC4)CC5=CC=CC=C5

Isomeric SMILES

CCOCC1=C(OC2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)N4CC[NH+](CC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H31N3O3/c1-2-34-21-26-25-10-6-7-11-27(25)35-28(26)29(33)30-23-12-14-24(15-13-23)32-18-16-31(17-19-32)20-22-8-4-3-5-9-22/h3-15H,2,16-21H2,1H3,(H,30,33)/p+1