N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-nitro-N-[(5-piperidin-1-ylfuran-2-yl)methyl]benzamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-nitro-N-[(5-piperidin-1-ylfuran-2-yl)methyl]benzamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-4-nitro-N-[[5-(1-piperidyl)-2-furyl]methyl]benzamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-4-nitro-N-[[5-(1-piperidinyl)-2-furanyl]methyl]benzamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-4-nitro-N-[(5-piperidin-1-ylfuran-2-yl)methyl]benzamide Traditional Name: N-(1,1-diketothiolan-3-yl)-4-nitro-N-[(5-piperidino-2-furyl)methyl]benzamide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(O2)CN(C3CCS(=O)(=O)C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=CC=C(O2)CN(C3CCS(=O)(=O)C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O6S/c25-21(16-4-6-17(7-5-16)24(26)27)23(18-10-13-31(28,29)15-18)14-19-8-9-20(30-19)22-11-2-1-3-12-22/h4-9,18H,1-3,10-15H2