N-(3-nitrophenyl)-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: N-(3-nitrophenyl)-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: 3-benzylsulfonyl-N-(3-nitrophenyl)propanamide CAS Name: N-(3-nitrophenyl)-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: 3-benzylsulfonyl-N-(3-nitrophenyl)propanamide Traditional Name: 3-benzylsulfonyl-N-(3-nitrophenyl)propionamide Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O5S/c19-16(17-14-7-4-8-15(11-14)18(20)21)9-10-24(22,23)12-13-5-2-1-3-6-13/h1-8,11H,9-10,12H2,(H,17,19)