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

Systemtic Name: (5-bromanyl-2-methoxy-3-methyl-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (5-bromo-2-methoxy-3-methyl-phenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (5-bromo-2-methoxy-3-methylphenyl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (5-bromo-2-methoxy-3-methylphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (5-bromo-2-methoxy-3-methyl-phenyl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C19H20BrN3O4 MolecularWeight: 434.2838

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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-])OC

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrN3O4/c1-13-11-14(20)12-17(18(13)27-2)19(24)22-9-7-21(8-10-22)15-3-5-16(6-4-15)23(25)26/h3-6,11-12H,7-10H2,1-2H3