3-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-6-nitro-1,3-benzoxazol-2-one

Systemtic Name: 3-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-6-nitro-1,3-benzoxazol-2-one Openeye Name: 3-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-6-nitro-1,3-benzoxazol-2-one CAS Name: 3-[2-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-6-nitro-1,3-benzoxazol-2-one IUPAC Name: 3-[2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-6-nitro-1,3-benzoxazol-2-one Traditional Name: 3-[2-[4-(3-fluorophenyl)sulfonylpiperazino]-2-keto-ethyl]-6-nitro-1,3-benzoxazol-2-one Formula: C19H17FN4O7S MolecularWeight: 464.424283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CN(CCN1C(=O)CN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C19H17FN4O7S/c20-13-2-1-3-15(10-13)32(29,30)22-8-6-21(7-9-22)18(25)12-23-16-5-4-14(24(27)28)11-17(16)31-19(23)26/h1-5,10-11H,6-9,12H2