[4-[(3-fluorophenyl)methylsulfonyl]-3-nitro-phenyl]-piperidin-1-yl-methanone

Systemtic Name: [4-[(3-fluorophenyl)methylsulfonyl]-3-nitro-phenyl]-piperidin-1-yl-methanone Openeye Name: [4-[(3-fluorophenyl)methylsulfonyl]-3-nitro-phenyl]-(1-piperidyl)methanone CAS Name: [4-[(3-fluorophenyl)methylsulfonyl]-3-nitrophenyl]-(1-piperidinyl)methanone IUPAC Name: [4-[(3-fluorophenyl)methylsulfonyl]-3-nitrophenyl]-piperidin-1-ylmethanone Traditional Name: [4-(3-fluorobenzyl)sulfonyl-3-nitro-phenyl]-piperidino-methanone Formula: C19H19FN2O5S MolecularWeight: 406.427963

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC(=C(C=C2)S(=O)(=O)CC3=CC(=CC=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC(=C(C=C2)S(=O)(=O)CC3=CC(=CC=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C19H19FN2O5S/c20-16-6-4-5-14(11-16)13-28(26,27)18-8-7-15(12-17(18)22(24)25)19(23)21-9-2-1-3-10-21/h4-8,11-12H,1-3,9-10,13H2