1-(4-nitrophenyl)-4-propan-2-ylsulfonyl-piperazine

Systemtic Name: 1-(4-nitrophenyl)-4-propan-2-ylsulfonyl-piperazine Openeye Name: 1-isopropylsulfonyl-4-(4-nitrophenyl)piperazine CAS Name: 1-(4-nitrophenyl)-4-propan-2-ylsulfonylpiperazine IUPAC Name: 1-(4-nitrophenyl)-4-propan-2-ylsulfonylpiperazine Traditional Name: 1-isopropylsulfonyl-4-(4-nitrophenyl)piperazine Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)S(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O4S/c1-11(2)21(19,20)15-9-7-14(8-10-15)12-3-5-13(6-4-12)16(17)18/h3-6,11H,7-10H2,1-2H3