1-(4-bromanyl-2-ethyl-phenyl)sulfonyl-4-(4-nitrophenyl)piperazine

Systemtic Name: 1-(4-bromanyl-2-ethyl-phenyl)sulfonyl-4-(4-nitrophenyl)piperazine Openeye Name: 1-(4-bromo-2-ethyl-phenyl)sulfonyl-4-(4-nitrophenyl)piperazine CAS Name: 1-(4-bromo-2-ethylphenyl)sulfonyl-4-(4-nitrophenyl)piperazine IUPAC Name: 1-(4-bromo-2-ethylphenyl)sulfonyl-4-(4-nitrophenyl)piperazine Traditional Name: 1-(4-bromo-2-ethyl-phenyl)sulfonyl-4-(4-nitrophenyl)piperazine Formula: C18H20BrN3O4S MolecularWeight: 454.3381

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20BrN3O4S/c1-2-14-13-15(19)3-8-18(14)27(25,26)21-11-9-20(10-12-21)16-4-6-17(7-5-16)22(23)24/h3-8,13H,2,9-12H2,1H3