N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclopropyl-2-(4-methoxy-2-nitro-phenoxy)ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclopropyl-2-(4-methoxy-2-nitro-phenoxy)ethanamide Openeye Name: N-cyclopropyl-N-[(3S)-1,1-dioxothiolan-3-yl]-2-(4-methoxy-2-nitro-phenoxy)acetamide CAS Name: N-cyclopropyl-N-[(3S)-1,1-dioxo-3-thiolanyl]-2-(4-methoxy-2-nitrophenoxy)acetamide IUPAC Name: N-cyclopropyl-N-[(3S)-1,1-dioxothiolan-3-yl]-2-(4-methoxy-2-nitrophenoxy)acetamide Traditional Name: N-cyclopropyl-N-[(3S)-1,1-diketothiolan-3-yl]-2-(4-methoxy-2-nitro-phenoxy)acetamide Formula: C16H20N2O7S MolecularWeight: 384.4042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCC(=O)N(C2CC2)C3CCS(=O)(=O)C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OCC(=O)N([C@H]2CCS(=O)(=O)C2)C3CC3)[N+](=O)[O-]

InChI

InChI=1S/C16H20N2O7S/c1-24-13-4-5-15(14(8-13)18(20)21)25-9-16(19)17(11-2-3-11)12-6-7-26(22,23)10-12/h4-5,8,11-12H,2-3,6-7,9-10H2,1H3/t12-/m0/s1