[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-pyrrolidin-1-yl-methanone Openeye Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-pyrrolidin-1-yl-methanone CAS Name: [4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]-pyrrolidin-1-ylmethanone Traditional Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]-pyrrolidino-methanone Formula: C16H22N4O6S MolecularWeight: 398.43408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O6S/c1-26-15-5-4-13(12-14(15)20(22)23)27(24,25)19-10-8-18(9-11-19)16(21)17-6-2-3-7-17/h4-5,12H,2-3,6-11H2,1H3