4-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-1-methyl-3-nitro-quinolin-2-one

Systemtic Name: 4-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-1-methyl-3-nitro-quinolin-2-one Openeye Name: 4-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-1-methyl-3-nitro-quinolin-2-one CAS Name: 4-[4-(2-hydroxyethyl)-1-piperazin-4-iumyl]-1-methyl-3-nitro-2-quinolinone IUPAC Name: 4-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-1-methyl-3-nitroquinolin-2-one Traditional Name: 4-[4-(2-hydroxyethyl)piperazin-4-ium-1-yl]-1-methyl-3-nitro-carbostyril Formula: C16H21N4O4+ MolecularWeight: 333.36234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CC[NH+](CC3)CCO

Isomeric SMILES

CN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CC[NH+](CC3)CCO

InChI

InChI=1S/C16H20N4O4/c1-17-13-5-3-2-4-12(13)14(15(16(17)22)20(23)24)19-8-6-18(7-9-19)10-11-21/h2-5,21H,6-11H2,1H3/p+1