(2-chloranyl-5-nitro-phenyl)-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (2-chloranyl-5-nitro-phenyl)-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]methanone Openeye Name: (2-chloro-5-nitro-phenyl)-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]methanone CAS Name: (2-chloro-5-nitrophenyl)-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (2-chloro-5-nitrophenyl)-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (2-chloro-5-nitro-phenyl)-[4-(4,5-dimethoxy-2-methyl-benzyl)piperazino]methanone Formula: C21H24ClN3O5 MolecularWeight: 433.88536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CCN(CC2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CCN(CC2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)OC)OC

InChI

InChI=1S/C21H24ClN3O5/c1-14-10-19(29-2)20(30-3)11-15(14)13-23-6-8-24(9-7-23)21(26)17-12-16(25(27)28)4-5-18(17)22/h4-5,10-12H,6-9,13H2,1-3H3