1-[(3-nitrophenyl)methylsulfonyl]-4-phenyl-piperazine

Systemtic Name: 1-[(3-nitrophenyl)methylsulfonyl]-4-phenyl-piperazine Openeye Name: 1-[(3-nitrophenyl)methylsulfonyl]-4-phenyl-piperazine CAS Name: 1-[(3-nitrophenyl)methylsulfonyl]-4-phenylpiperazine IUPAC Name: 1-[(3-nitrophenyl)methylsulfonyl]-4-phenylpiperazine Traditional Name: 1-(3-nitrobenzyl)sulfonyl-4-phenyl-piperazine Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O4S/c21-20(22)17-8-4-5-15(13-17)14-25(23,24)19-11-9-18(10-12-19)16-6-2-1-3-7-16/h1-8,13H,9-12,14H2