1-(2-methyl-3-nitro-phenyl)sulfonyl-4-propan-2-yl-piperazine

Systemtic Name: 1-(2-methyl-3-nitro-phenyl)sulfonyl-4-propan-2-yl-piperazine Openeye Name: 1-isopropyl-4-(2-methyl-3-nitro-phenyl)sulfonyl-piperazine CAS Name: 1-(2-methyl-3-nitrophenyl)sulfonyl-4-propan-2-ylpiperazine IUPAC Name: 1-(2-methyl-3-nitrophenyl)sulfonyl-4-propan-2-ylpiperazine Traditional Name: 1-isopropyl-4-(2-methyl-3-nitro-phenyl)sulfonyl-piperazine Formula: C14H21N3O4S MolecularWeight: 327.39924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O4S/c1-11(2)15-7-9-16(10-8-15)22(20,21)14-6-4-5-13(12(14)3)17(18)19/h4-6,11H,7-10H2,1-3H3