(2S)-N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-2-(4-nitrophenyl)sulfonyl-propanamide

Systemtic Name: (2S)-N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-2-(4-nitrophenyl)sulfonyl-propanamide Openeye Name: (2S)-N-[2-(2-ethylanilino)-2-oxo-ethyl]-2-(4-nitrophenyl)sulfonyl-propanamide CAS Name: (2S)-N-[2-(2-ethylanilino)-2-oxoethyl]-2-(4-nitrophenyl)sulfonylpropanamide IUPAC Name: (2S)-N-[2-(2-ethylanilino)-2-oxoethyl]-2-(4-nitrophenyl)sulfonylpropanamide Traditional Name: (2S)-N-[2-(2-ethylanilino)-2-keto-ethyl]-2-nosyl-propionamide Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CNC(=O)C(C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CNC(=O)[C@H](C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O6S/c1-3-14-6-4-5-7-17(14)21-18(23)12-20-19(24)13(2)29(27,28)16-10-8-15(9-11-16)22(25)26/h4-11,13H,3,12H2,1-2H3,(H,20,24)(H,21,23)/t13-/m0/s1