(2S)-N-(2,2-diethoxyethyl)-2-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(2,2-diethoxyethyl)-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: (2S)-N-(2,2-diethoxyethyl)-2-(4-nitrophenyl)sulfanyl-propanamide CAS Name: (2S)-N-(2,2-diethoxyethyl)-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: (2S)-N-(2,2-diethoxyethyl)-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: (2S)-N-(2,2-diethoxyethyl)-2-[(4-nitrophenyl)thio]propionamide Formula: C15H22N2O5S MolecularWeight: 342.41058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CNC(=O)C(C)SC1=CC=C(C=C1)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC(CNC(=O)[C@H](C)SC1=CC=C(C=C1)[N+](=O)[O-])OCC

InChI

InChI=1S/C15H22N2O5S/c1-4-21-14(22-5-2)10-16-15(18)11(3)23-13-8-6-12(7-9-13)17(19)20/h6-9,11,14H,4-5,10H2,1-3H3,(H,16,18)/t11-/m0/s1