(5-bromanyl-2-methoxy-3-methyl-phenyl)-[4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]methanone

Systemtic Name: (5-bromanyl-2-methoxy-3-methyl-phenyl)-[4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]methanone Openeye Name: (5-bromo-2-methoxy-3-methyl-phenyl)-[4-(2-chloro-6-nitro-phenyl)piperazin-1-yl]methanone CAS Name: (5-bromo-2-methoxy-3-methylphenyl)-[4-(2-chloro-6-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (5-bromo-2-methoxy-3-methylphenyl)-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (5-bromo-2-methoxy-3-methyl-phenyl)-[4-(2-chloro-6-nitro-phenyl)piperazino]methanone Formula: C19H19BrClN3O4 MolecularWeight: 468.72886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)[N+](=O)[O-])OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C19H19BrClN3O4/c1-12-10-13(20)11-14(18(12)28-2)19(25)23-8-6-22(7-9-23)17-15(21)4-3-5-16(17)24(26)27/h3-5,10-11H,6-9H2,1-2H3