[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-(5-nitrofuran-2-yl)methanone

Systemtic Name: [4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-(5-nitrofuran-2-yl)methanone Openeye Name: [4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-(5-nitro-2-furyl)methanone CAS Name: [4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-(5-nitro-2-furanyl)methanone IUPAC Name: [4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-(5-nitrofuran-2-yl)methanone Traditional Name: [4-(4-tert-butylphenyl)sulfonylpiperazino]-(5-nitro-2-furyl)methanone Formula: C19H23N3O6S MolecularWeight: 421.46742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O6S/c1-19(2,3)14-4-6-15(7-5-14)29(26,27)21-12-10-20(11-13-21)18(23)16-8-9-17(28-16)22(24)25/h4-9H,10-13H2,1-3H3