1-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)azocane

Systemtic Name: 1-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)azocane Openeye Name: 1-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)azocane CAS Name: 1-[4-nitro-2-(1-pyrrolidinylsulfonyl)phenyl]azocane IUPAC Name: 1-(4-nitro-2-pyrrolidin-1-ylsulfonylphenyl)azocane Traditional Name: 1-(4-nitro-2-pyrrolidinosulfonyl-phenyl)azocane Formula: C17H25N3O4S MolecularWeight: 367.4631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCCC3

Isomeric SMILES

C1CCCN(CCC1)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCCC3

InChI

InChI=1S/C17H25N3O4S/c21-20(22)15-8-9-16(18-10-4-2-1-3-5-11-18)17(14-15)25(23,24)19-12-6-7-13-19/h8-9,14H,1-7,10-13H2