(5-bromanyl-2-methoxy-phenyl)-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]methanone

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]methanone Openeye Name: (5-bromo-2-methoxy-phenyl)-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]methanone CAS Name: (5-bromo-2-methoxyphenyl)-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (5-bromo-2-methoxyphenyl)-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (5-bromo-2-methoxy-phenyl)-[4-(4-chloro-2-nitro-phenyl)piperazino]methanone Formula: C18H17BrClN3O4 MolecularWeight: 454.70228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H17BrClN3O4/c1-27-17-5-2-12(19)10-14(17)18(24)22-8-6-21(7-9-22)15-4-3-13(20)11-16(15)23(25)26/h2-5,10-11H,6-9H2,1H3