[4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-yl]-(4-nitrophenyl)methanone

Systemtic Name: [4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-yl]-(4-nitrophenyl)methanone Openeye Name: [4-(4-bromo-2-chloro-phenyl)sulfonylpiperazin-1-yl]-(4-nitrophenyl)methanone CAS Name: [4-(4-bromo-2-chlorophenyl)sulfonyl-1-piperazinyl]-(4-nitrophenyl)methanone IUPAC Name: [4-(4-bromo-2-chlorophenyl)sulfonylpiperazin-1-yl]-(4-nitrophenyl)methanone Traditional Name: [4-(4-bromo-2-chloro-phenyl)sulfonylpiperazino]-(4-nitrophenyl)methanone Formula: C17H15BrClN3O5S MolecularWeight: 488.7401

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C17H15BrClN3O5S/c18-13-3-6-16(15(19)11-13)28(26,27)21-9-7-20(8-10-21)17(23)12-1-4-14(5-2-12)22(24)25/h1-6,11H,7-10H2