N-tert-butyl-4-[[1-(furan-2-ylcarbonyl)piperidin-4-yl]amino]-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-[[1-(furan-2-ylcarbonyl)piperidin-4-yl]amino]-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-[[1-(furan-2-carbonyl)-4-piperidyl]amino]-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-[[1-[2-furanyl(oxo)methyl]-4-piperidinyl]amino]-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-[[1-(furan-2-carbonyl)piperidin-4-yl]amino]-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-[[1-(2-furoyl)-4-piperidyl]amino]-3-nitro-benzenesulfonamide Formula: C20H26N4O6S MolecularWeight: 450.50864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NC2CCN(CC2)C(=O)C3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NC2CCN(CC2)C(=O)C3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C20H26N4O6S/c1-20(2,3)22-31(28,29)15-6-7-16(17(13-15)24(26)27)21-14-8-10-23(11-9-14)19(25)18-5-4-12-30-18/h4-7,12-14,21-22H,8-11H2,1-3H3