N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2-(5-methyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2-(5-methyl-2-nitro-phenoxy)ethanamide Openeye Name: N-butyl-N-(1,1-dioxothiolan-3-yl)-2-(5-methyl-2-nitro-phenoxy)acetamide CAS Name: N-butyl-N-(1,1-dioxo-3-thiolanyl)-2-(5-methyl-2-nitrophenoxy)acetamide IUPAC Name: N-butyl-N-(1,1-dioxothiolan-3-yl)-2-(5-methyl-2-nitrophenoxy)acetamide Traditional Name: N-butyl-N-(1,1-diketothiolan-3-yl)-2-(5-methyl-2-nitro-phenoxy)acetamide Formula: C17H24N2O6S MolecularWeight: 384.44726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CCS(=O)(=O)C1)C(=O)COC2=C(C=CC(=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCCCN(C1CCS(=O)(=O)C1)C(=O)COC2=C(C=CC(=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C17H24N2O6S/c1-3-4-8-18(14-7-9-26(23,24)12-14)17(20)11-25-16-10-13(2)5-6-15(16)19(21)22/h5-6,10,14H,3-4,7-9,11-12H2,1-2H3