1-(4-nitrophenyl)-4-(phenylmethyl)sulfonyl-piperazine

Systemtic Name: 1-(4-nitrophenyl)-4-(phenylmethyl)sulfonyl-piperazine Openeye Name: 1-benzylsulfonyl-4-(4-nitrophenyl)piperazine CAS Name: 1-(4-nitrophenyl)-4-(phenylmethyl)sulfonylpiperazine IUPAC Name: 1-benzylsulfonyl-4-(4-nitrophenyl)piperazine Traditional Name: 1-benzylsulfonyl-4-(4-nitrophenyl)piperazine Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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