N-[3-oxidanylidene-1-[2-oxidanyl-4-(phenylmethyl)-3-propan-2-ylsulfonyl-phenyl]propyl]methanamide

Systemtic Name: N-[3-oxidanylidene-1-[2-oxidanyl-4-(phenylmethyl)-3-propan-2-ylsulfonyl-phenyl]propyl]methanamide Openeye Name: N-[1-(4-benzyl-2-hydroxy-3-isopropylsulfonyl-phenyl)-3-oxo-propyl]formamide CAS Name: N-[1-[2-hydroxy-4-(phenylmethyl)-3-propan-2-ylsulfonylphenyl]-3-oxopropyl]formamide IUPAC Name: N-[1-(4-benzyl-2-hydroxy-3-propan-2-ylsulfonylphenyl)-3-oxopropyl]formamide Traditional Name: N-[1-(4-benzyl-2-hydroxy-3-isopropylsulfonyl-phenyl)-3-keto-propyl]formamide Formula: C20H23NO5S MolecularWeight: 389.46532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(C=CC(=C1O)C(CC=O)NC=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(C=CC(=C1O)C(CC=O)NC=O)CC2=CC=CC=C2

InChI

InChI=1S/C20H23NO5S/c1-14(2)27(25,26)20-16(12-15-6-4-3-5-7-15)8-9-17(19(20)24)18(10-11-22)21-13-23/h3-9,11,13-14,18,24H,10,12H2,1-2H3,(H,21,23)