N-cyclohexyl-4-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)piperazine-1-carboxamide

Systemtic Name: N-cyclohexyl-4-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)piperazine-1-carboxamide Openeye Name: N-cyclohexyl-4-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)piperazine-1-carboxamide CAS Name: N-cyclohexyl-4-[4-nitro-2-(1-pyrrolidinylsulfonyl)phenyl]-1-piperazinecarboxamide IUPAC Name: N-cyclohexyl-4-(4-nitro-2-pyrrolidin-1-ylsulfonylphenyl)piperazine-1-carboxamide Traditional Name: N-cyclohexyl-4-(4-nitro-2-pyrrolidinosulfonyl-phenyl)piperazine-1-carboxamide Formula: C21H31N5O5S MolecularWeight: 465.56634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCCC4

Isomeric SMILES

C1CCC(CC1)NC(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H31N5O5S/c27-21(22-17-6-2-1-3-7-17)24-14-12-23(13-15-24)19-9-8-18(26(28)29)16-20(19)32(30,31)25-10-4-5-11-25/h8-9,16-17H,1-7,10-15H2,(H,22,27)