N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-methoxy-3-nitro-N-(oxolan-2-ylmethyl)benzamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-4-methoxy-3-nitro-N-(oxolan-2-ylmethyl)benzamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-4-methoxy-3-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-4-methoxy-3-nitro-N-(2-oxolanylmethyl)benzamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-4-methoxy-3-nitro-N-(oxolan-2-ylmethyl)benzamide Traditional Name: N-(1,1-diketothiolan-3-yl)-4-methoxy-3-nitro-N-(tetrahydrofurfuryl)benzamide Formula: C17H22N2O7S MolecularWeight: 398.43078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N(CC2CCCO2)C3CCS(=O)(=O)C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(CC2CCCO2)C3CCS(=O)(=O)C3)[N+](=O)[O-]

InChI

InChI=1S/C17H22N2O7S/c1-25-16-5-4-12(9-15(16)19(21)22)17(20)18(10-14-3-2-7-26-14)13-6-8-27(23,24)11-13/h4-5,9,13-14H,2-3,6-8,10-11H2,1H3