N-[(1R,2R)-2-bromanyl-3-oxidanylidene-1-(3,4,5-trimethoxyphenyl)butyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(1R,2R)-2-bromanyl-3-oxidanylidene-1-(3,4,5-trimethoxyphenyl)butyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1R,2R)-2-bromo-3-oxo-1-(3,4,5-trimethoxyphenyl)butyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1R,2R)-2-bromo-3-oxo-1-(3,4,5-trimethoxyphenyl)butyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(1R,2R)-2-bromo-3-oxo-1-(3,4,5-trimethoxyphenyl)butyl]-4-methylbenzenesulfonamide Traditional Name: N-[(1R,2R)-2-bromo-3-keto-1-(3,4,5-trimethoxyphenyl)butyl]-4-methyl-benzenesulfonamide Formula: C20H24BrNO6S MolecularWeight: 486.37666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC(=C(C(=C2)OC)OC)OC)C(C(=O)C)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H](C2=CC(=C(C(=C2)OC)OC)OC)[C@H](C(=O)C)Br

InChI

InChI=1S/C20H24BrNO6S/c1-12-6-8-15(9-7-12)29(24,25)22-19(18(21)13(2)23)14-10-16(26-3)20(28-5)17(11-14)27-4/h6-11,18-19,22H,1-5H3/t18-,19+/m0/s1