N-(4-bromanyl-3-methyl-phenyl)-2,3-dimethoxy-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2,3-dimethoxy-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2,3-dimethoxy-5-morpholinosulfonyl-benzamide CAS Name: N-(4-bromo-3-methylphenyl)-2,3-dimethoxy-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2,3-dimethoxy-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2,3-dimethoxy-5-morpholinosulfonyl-benzamide Formula: C20H23BrN2O6S MolecularWeight: 499.37542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC(=CC(=C2OC)OC)S(=O)(=O)N3CCOCC3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC(=CC(=C2OC)OC)S(=O)(=O)N3CCOCC3)Br

InChI

InChI=1S/C20H23BrN2O6S/c1-13-10-14(4-5-17(13)21)22-20(24)16-11-15(12-18(27-2)19(16)28-3)30(25,26)23-6-8-29-9-7-23/h4-5,10-12H,6-9H2,1-3H3,(H,22,24)