N-[3,5-bis(chloranyl)phenyl]-4-(furan-2-ylmethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-[3,5-bis(chloranyl)phenyl]-4-(furan-2-ylmethyl)piperazin-4-ium-1-carboxamide Openeye Name: N-(3,5-dichlorophenyl)-4-(2-furylmethyl)piperazin-4-ium-1-carboxamide CAS Name: N-(3,5-dichlorophenyl)-4-(2-furanylmethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-(3,5-dichlorophenyl)-4-(furan-2-ylmethyl)piperazin-4-ium-1-carboxamide Traditional Name: N-(3,5-dichlorophenyl)-4-(2-furfuryl)piperazin-4-ium-1-carboxamide Formula: C16H18Cl2N3O2+ MolecularWeight: 355.23902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CO2)C(=O)NC3=CC(=CC(=C3)Cl)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CO2)C(=O)NC3=CC(=CC(=C3)Cl)Cl

InChI

InChI=1S/C16H17Cl2N3O2/c17-12-8-13(18)10-14(9-12)19-16(22)21-5-3-20(4-6-21)11-15-2-1-7-23-15/h1-2,7-10H,3-6,11H2,(H,19,22)/p+1