[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-[(1S,2S)-2-methylcyclopropyl]methanone

Systemtic Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-[(1S,2S)-2-methylcyclopropyl]methanone Openeye Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-[(1S,2S)-2-methylcyclopropyl]methanone CAS Name: [4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]-[(1S,2S)-2-methylcyclopropyl]methanone IUPAC Name: [4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]-[(1S,2S)-2-methylcyclopropyl]methanone Traditional Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]-[(1S,2S)-2-methylcyclopropyl]methanone Formula: C16H21N3O6S MolecularWeight: 383.41944

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1C[C@@H]1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O6S/c1-11-9-13(11)16(20)17-5-7-18(8-6-17)26(23,24)12-3-4-15(25-2)14(10-12)19(21)22/h3-4,10-11,13H,5-9H2,1-2H3/t11-,13-/m0/s1