1-(3-chlorophenyl)-4-[(5-nitrofuran-2-yl)methyl]piperazin-4-ium

Systemtic Name: 1-(3-chlorophenyl)-4-[(5-nitrofuran-2-yl)methyl]piperazin-4-ium Openeye Name: 1-(3-chlorophenyl)-4-[(5-nitro-2-furyl)methyl]piperazin-4-ium CAS Name: 1-(3-chlorophenyl)-4-[(5-nitro-2-furanyl)methyl]piperazin-4-ium IUPAC Name: 1-(3-chlorophenyl)-4-[(5-nitrofuran-2-yl)methyl]piperazin-4-ium Traditional Name: 1-(3-chlorophenyl)-4-[(5-nitro-2-furyl)methyl]piperazin-4-ium Formula: C15H17ClN3O3+ MolecularWeight: 322.76678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(O2)[N+](=O)[O-])C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(O2)[N+](=O)[O-])C3=CC(=CC=C3)Cl

InChI

InChI=1S/C15H16ClN3O3/c16-12-2-1-3-13(10-12)18-8-6-17(7-9-18)11-14-4-5-15(22-14)19(20)21/h1-5,10H,6-9,11H2/p+1