4-(4-nitrophenyl)carbonyl-3-thiophen-2-yl-piperazin-2-one

Systemtic Name: 4-(4-nitrophenyl)carbonyl-3-thiophen-2-yl-piperazin-2-one Openeye Name: 4-(4-nitrobenzoyl)-3-(2-thienyl)piperazin-2-one CAS Name: 4-[(4-nitrophenyl)-oxomethyl]-3-thiophen-2-yl-2-piperazinone IUPAC Name: 4-(4-nitrobenzoyl)-3-thiophen-2-ylpiperazin-2-one Traditional Name: 4-(4-nitrobenzoyl)-3-(2-thienyl)piperazin-2-one Formula: C15H13N3O4S MolecularWeight: 331.34642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)C2=CC=CS2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(C(C(=O)N1)C2=CC=CS2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O4S/c19-14-13(12-2-1-9-23-12)17(8-7-16-14)15(20)10-3-5-11(6-4-10)18(21)22/h1-6,9,13H,7-8H2,(H,16,19)