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

Systemtic Name: 1-methyl-4-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-3-nitro-quinolin-2-one Openeye Name: 1-methyl-4-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-3-nitro-quinolin-2-one CAS Name: 1-methyl-4-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-3-nitro-2-quinolinone IUPAC Name: 1-methyl-4-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-3-nitroquinolin-2-one Traditional Name: 1-methyl-4-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-3-nitro-carbostyril Formula: C25H25N4O3+ MolecularWeight: 429.491

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CC[NH+](CC3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CC[NH+](CC3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H24N4O3/c1-26-22-12-5-4-11-21(22)23(24(25(26)30)29(31)32)28-15-13-27(14-16-28)17-19-9-6-8-18-7-2-3-10-20(18)19/h2-12H,13-17H2,1H3/p+1