[1-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperidin-4-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperidin-4-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-(4-morpholinosulfonyl-2-nitro-phenyl)-4-piperidyl]-pyrrolidin-1-yl-methanone CAS Name: [1-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-4-piperidinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-(4-morpholinosulfonyl-2-nitro-phenyl)-4-piperidyl]-pyrrolidino-methanone Formula: C20H28N4O6S MolecularWeight: 452.52452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)C2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H28N4O6S/c25-20(22-7-1-2-8-22)16-5-9-21(10-6-16)18-4-3-17(15-19(18)24(26)27)31(28,29)23-11-13-30-14-12-23/h3-4,15-16H,1-2,5-14H2