1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-4-(4-nitrophenyl)piperazine

Systemtic Name: 1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-4-(4-nitrophenyl)piperazine Openeye Name: 1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-4-(4-nitrophenyl)piperazine CAS Name: 1-(4-methoxy-2,3,6-trimethylphenyl)sulfonyl-4-(4-nitrophenyl)piperazine IUPAC Name: 1-(4-methoxy-2,3,6-trimethylphenyl)sulfonyl-4-(4-nitrophenyl)piperazine Traditional Name: 1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-4-(4-nitrophenyl)piperazine Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C)C)OC

InChI

InChI=1S/C20H25N3O5S/c1-14-13-19(28-4)15(2)16(3)20(14)29(26,27)22-11-9-21(10-12-22)17-5-7-18(8-6-17)23(24)25/h5-8,13H,9-12H2,1-4H3