4-[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-1-methyl-3-nitro-quinolin-2-one

Systemtic Name: 4-[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-1-methyl-3-nitro-quinolin-2-one Openeye Name: 4-[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-1-methyl-3-nitro-quinolin-2-one CAS Name: 4-[4-[(2,4-dichlorophenyl)methyl]-1-piperazinyl]-1-methyl-3-nitro-2-quinolinone IUPAC Name: 4-[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]-1-methyl-3-nitroquinolin-2-one Traditional Name: 4-[4-(2,4-dichlorobenzyl)piperazino]-1-methyl-3-nitro-carbostyril Formula: C21H20Cl2N4O3 MolecularWeight: 447.3145

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CCN(CC3)CC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CN1C2=CC=CC=C2C(=C(C1=O)[N+](=O)[O-])N3CCN(CC3)CC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H20Cl2N4O3/c1-24-18-5-3-2-4-16(18)19(20(21(24)28)27(29)30)26-10-8-25(9-11-26)13-14-6-7-15(22)12-17(14)23/h2-7,12H,8-11,13H2,1H3