1-(4-nitrophenyl)-3-thiomorpholin-4-yl-propan-1-one hydrochloride

Systemtic Name: 1-(4-nitrophenyl)-3-thiomorpholin-4-yl-propan-1-one hydrochloride Openeye Name: 1-(4-nitrophenyl)-3-thiomorpholino-propan-1-one hydrochloride CAS Name: 1-(4-nitrophenyl)-3-thiomorpholin-4-yl-1-propanone hydrochloride IUPAC Name: 1-(4-nitrophenyl)-3-thiomorpholin-4-ylpropan-1-one hydrochloride Traditional Name: 1-(4-nitrophenyl)-3-thiomorpholino-propan-1-one hydrochloride Formula: C13H17ClN2O3S MolecularWeight: 316.80368

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1CCC(=O)C2=CC=C(C=C2)[N+](=O)[O-].Cl

Isomeric SMILES

C1CSCCN1CCC(=O)C2=CC=C(C=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C13H16N2O3S.ClH/c16-13(5-6-14-7-9-19-10-8-14)11-1-3-12(4-2-11)15(17)18;/h1-4H,5-10H2;1H