4-[4-(azepan-1-yl)-3-nitro-phenyl]sulfonylmorpholine

Systemtic Name: 4-[4-(azepan-1-yl)-3-nitro-phenyl]sulfonylmorpholine Openeye Name: 4-[4-(azepan-1-yl)-3-nitro-phenyl]sulfonylmorpholine CAS Name: 4-[4-(1-azepanyl)-3-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-[4-(azepan-1-yl)-3-nitrophenyl]sulfonylmorpholine Traditional Name: 4-[4-(azepan-1-yl)-3-nitro-phenyl]sulfonylmorpholine Formula: C16H23N3O5S MolecularWeight: 369.43592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O5S/c20-19(21)16-13-14(25(22,23)18-9-11-24-12-10-18)5-6-15(16)17-7-3-1-2-4-8-17/h5-6,13H,1-4,7-12H2