2-nitro-N-[(2S,3R)-3-oxidanylpent-4-en-2-yl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 2-nitro-N-[(2S,3R)-3-oxidanylpent-4-en-2-yl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-N-[(1S,2R)-2-hydroxy-1-methyl-but-3-enyl]-2-nitro-benzenesulfonamide CAS Name: N-[(2S,3R)-3-hydroxypent-4-en-2-yl]-2-nitro-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-N-[(2S,3R)-3-hydroxypent-4-en-2-yl]-2-nitrobenzenesulfonamide Traditional Name: N-benzyl-N-[(1S,2R)-2-hydroxy-1-methyl-but-3-enyl]-2-nitro-benzenesulfonamide Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C=C)O)N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C[C@@H]([C@@H](C=C)O)N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O5S/c1-3-17(21)14(2)19(13-15-9-5-4-6-10-15)26(24,25)18-12-8-7-11-16(18)20(22)23/h3-12,14,17,21H,1,13H2,2H3/t14-,17+/m0/s1