1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-phenyl-ethanone

Systemtic Name: 1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-phenyl-ethanone Openeye Name: 1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-phenyl-ethanone CAS Name: 1-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-2-phenylethanone IUPAC Name: 1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-phenylethanone Traditional Name: 1-[4-(3-nitrophenyl)sulfonylpiperazino]-2-phenyl-ethanone Formula: C18H19N3O5S MolecularWeight: 389.42556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5S/c22-18(13-15-5-2-1-3-6-15)19-9-11-20(12-10-19)27(25,26)17-8-4-7-16(14-17)21(23)24/h1-8,14H,9-13H2