N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide

Systemtic Name: N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Openeye Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-2-methyl-1-methylsulfonyl-indoline-5-carboxamide CAS Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide IUPAC Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Traditional Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-1-mesyl-2-methyl-indoline-5-carboxamide Formula: C20H23BrN2O4S MolecularWeight: 467.37662

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)NC(C)C3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)NC(C)C3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C20H23BrN2O4S/c1-12-9-16-10-15(5-7-18(16)23(12)28(4,25)26)20(24)22-13(2)14-6-8-19(27-3)17(21)11-14/h5-8,10-13H,9H2,1-4H3,(H,22,24)