1-[(2-nitrophenyl)methyl]-4-(4-propan-2-ylphenyl)sulfonyl-piperazine

Systemtic Name: 1-[(2-nitrophenyl)methyl]-4-(4-propan-2-ylphenyl)sulfonyl-piperazine Openeye Name: 1-(4-isopropylphenyl)sulfonyl-4-[(2-nitrophenyl)methyl]piperazine CAS Name: 1-[(2-nitrophenyl)methyl]-4-(4-propan-2-ylphenyl)sulfonylpiperazine IUPAC Name: 1-[(2-nitrophenyl)methyl]-4-(4-propan-2-ylphenyl)sulfonylpiperazine Traditional Name: 1-(2-nitrobenzyl)-4-p-cumenylsulfonyl-piperazine Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O4S/c1-16(2)17-7-9-19(10-8-17)28(26,27)22-13-11-21(12-14-22)15-18-5-3-4-6-20(18)23(24)25/h3-10,16H,11-15H2,1-2H3