N-[(1S)-1-(4-methylsulfonylphenyl)ethyl]-4-nitro-benzamide

Systemtic Name: N-[(1S)-1-(4-methylsulfonylphenyl)ethyl]-4-nitro-benzamide Openeye Name: N-[(1S)-1-(4-methylsulfonylphenyl)ethyl]-4-nitro-benzamide CAS Name: N-[(1S)-1-(4-methylsulfonylphenyl)ethyl]-4-nitrobenzamide IUPAC Name: N-[(1S)-1-(4-methylsulfonylphenyl)ethyl]-4-nitrobenzamide Traditional Name: N-[(1S)-1-(4-mesylphenyl)ethyl]-4-nitro-benzamide Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O5S/c1-11(12-5-9-15(10-6-12)24(2,22)23)17-16(19)13-3-7-14(8-4-13)18(20)21/h3-11H,1-2H3,(H,17,19)/t11-/m0/s1