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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-methyl-3-nitro-N-propyl-benzamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-4-methyl-3-nitro-N-propyl-benzamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-4-methyl-3-nitro-N-propylbenzamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-4-methyl-3-nitro-N-propylbenzamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-4-methyl-3-nitro-N-propyl-benzamide Formula: C15H20N2O5S MolecularWeight: 340.3947

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCN([C@H]1CCS(=O)(=O)C1)C(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O5S/c1-3-7-16(13-6-8-23(21,22)10-13)15(18)12-5-4-11(2)14(9-12)17(19)20/h4-5,9,13H,3,6-8,10H2,1-2H3/t13-/m0/s1