4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-1H-quinolin-2-one

Systemtic Name: 4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-1H-quinolin-2-one Openeye Name: 4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carbonyl]-1H-quinolin-2-one CAS Name: 4-[[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-oxomethyl]-1H-quinolin-2-one IUPAC Name: 4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carbonyl]-1H-quinolin-2-one Traditional Name: 4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carbonyl]carbostyril Formula: C21H17F3N4O4 MolecularWeight: 446.37929

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)C3=CC(=O)NC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)C3=CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C21H17F3N4O4/c22-21(23,24)13-5-6-17(18(11-13)28(31)32)26-7-9-27(10-8-26)20(30)15-12-19(29)25-16-4-2-1-3-14(15)16/h1-6,11-12H,7-10H2,(H,25,29)