5-bromanyl-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]furan-2-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-5-bromo-furan-2-carboxamide CAS Name: 5-bromo-N-[2-oxo-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethyl]-2-furancarboxamide IUPAC Name: N-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxoethyl]-5-bromofuran-2-carboxamide Traditional Name: N-[2-(4-benzylpiperazin-4-ium-1-yl)-2-keto-ethyl]-5-bromo-2-furamide Formula: C18H21BrN3O3+ MolecularWeight: 407.28164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)CNC(=O)C3=CC=C(O3)Br

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)CNC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C18H20BrN3O3/c19-16-7-6-15(25-16)18(24)20-12-17(23)22-10-8-21(9-11-22)13-14-4-2-1-3-5-14/h1-7H,8-13H2,(H,20,24)/p+1