1-(3-imidazol-1-yl-4-nitro-phenyl)-4-(phenylsulfonyl)piperazine

Systemtic Name: 1-(3-imidazol-1-yl-4-nitro-phenyl)-4-(phenylsulfonyl)piperazine Openeye Name: 1-(benzenesulfonyl)-4-(3-imidazol-1-yl-4-nitro-phenyl)piperazine CAS Name: 1-(benzenesulfonyl)-4-[3-(1-imidazolyl)-4-nitrophenyl]piperazine IUPAC Name: 1-(benzenesulfonyl)-4-(3-imidazol-1-yl-4-nitrophenyl)piperazine Traditional Name: 1-besyl-4-(3-imidazol-1-yl-4-nitro-phenyl)piperazine Formula: C19H19N5O4S MolecularWeight: 413.45026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])N3C=CN=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])N3C=CN=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H19N5O4S/c25-24(26)18-7-6-16(14-19(18)22-9-8-20-15-22)21-10-12-23(13-11-21)29(27,28)17-4-2-1-3-5-17/h1-9,14-15H,10-13H2