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

Systemtic Name: (2-chloranyl-5-iodanyl-phenyl)-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]methanone Openeye Name: (2-chloro-5-iodo-phenyl)-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]methanone CAS Name: (2-chloro-5-iodophenyl)-[4-(4-methoxy-2-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (2-chloro-5-iodophenyl)-[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (2-chloro-5-iodo-phenyl)-[4-(4-methoxy-2-nitro-phenyl)piperazino]methanone Formula: C18H17ClIN3O4 MolecularWeight: 501.70275

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClIN3O4/c1-27-13-3-5-16(17(11-13)23(25)26)21-6-8-22(9-7-21)18(24)14-10-12(20)2-4-15(14)19/h2-5,10-11H,6-9H2,1H3