(5-bromanyl-2-methoxy-3-methyl-phenyl)-[4-(3-morpholin-4-yl-4-nitro-phenyl)piperazin-1-yl]methanone

Systemtic Name: (5-bromanyl-2-methoxy-3-methyl-phenyl)-[4-(3-morpholin-4-yl-4-nitro-phenyl)piperazin-1-yl]methanone Openeye Name: (5-bromo-2-methoxy-3-methyl-phenyl)-[4-(3-morpholino-4-nitro-phenyl)piperazin-1-yl]methanone CAS Name: (5-bromo-2-methoxy-3-methylphenyl)-[4-[3-(4-morpholinyl)-4-nitrophenyl]-1-piperazinyl]methanone IUPAC Name: (5-bromo-2-methoxy-3-methylphenyl)-[4-(3-morpholin-4-yl-4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (5-bromo-2-methoxy-3-methyl-phenyl)-[4-(3-morpholino-4-nitro-phenyl)piperazino]methanone Formula: C23H27BrN4O5 MolecularWeight: 519.38828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])N4CCOCC4)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])N4CCOCC4)OC

InChI

InChI=1S/C23H27BrN4O5/c1-16-13-17(24)14-19(22(16)32-2)23(29)27-7-5-25(6-8-27)18-3-4-20(28(30)31)21(15-18)26-9-11-33-12-10-26/h3-4,13-15H,5-12H2,1-2H3