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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-chloranyl-4-nitro-N-propyl-benzamide Openeye Name: 2-chloro-N-[(3S)-1,1-dioxothiolan-3-yl]-4-nitro-N-propyl-benzamide CAS Name: 2-chloro-N-[(3S)-1,1-dioxo-3-thiolanyl]-4-nitro-N-propylbenzamide IUPAC Name: 2-chloro-N-[(3S)-1,1-dioxothiolan-3-yl]-4-nitro-N-propylbenzamide Traditional Name: 2-chloro-N-[(3S)-1,1-diketothiolan-3-yl]-4-nitro-N-propyl-benzamide Formula: C14H17ClN2O5S MolecularWeight: 360.81318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17ClN2O5S/c1-2-6-16(11-5-7-23(21,22)9-11)14(18)12-4-3-10(17(19)20)8-13(12)15/h3-4,8,11H,2,5-7,9H2,1H3/t11-/m0/s1