N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(4-methoxyphenyl)methyl]-2-nitro-benzamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(4-methoxyphenyl)methyl]-2-nitro-benzamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-[(4-methoxyphenyl)methyl]-2-nitro-benzamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-N-[(4-methoxyphenyl)methyl]-2-nitrobenzamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-N-[(4-methoxyphenyl)methyl]-2-nitrobenzamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-2-nitro-N-p-anisyl-benzamide Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CN([C@H]2CCS(=O)(=O)C2)C(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O6S/c1-27-16-8-6-14(7-9-16)12-20(15-10-11-28(25,26)13-15)19(22)17-4-2-3-5-18(17)21(23)24/h2-9,15H,10-13H2,1H3/t15-/m0/s1