(5-bromanyl-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl-(3,4-dimethylphenyl)azanide

Systemtic Name: (5-bromanyl-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl-(3,4-dimethylphenyl)azanide Openeye Name: (5-bromo-1-propanoyl-indolin-7-yl)sulfonyl-(3,4-dimethylphenyl)azanide CAS Name: [5-bromo-1-(1-oxopropyl)-2,3-dihydroindol-7-yl]sulfonyl-(3,4-dimethylphenyl)azanide IUPAC Name: (5-bromo-1-propanoyl-2,3-dihydroindol-7-yl)sulfonyl-(3,4-dimethylphenyl)azanide Traditional Name: (5-bromo-1-propionyl-indolin-7-yl)sulfonyl-(3,4-dimethylphenyl)azanide Formula: C19H20BrN2O3S- MolecularWeight: 436.3427

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)[N-]C3=CC(=C(C=C3)C)C)Br

Isomeric SMILES

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)[N-]C3=CC(=C(C=C3)C)C)Br

InChI

InChI=1S/C19H20BrN2O3S/c1-4-18(23)22-8-7-14-10-15(20)11-17(19(14)22)26(24,25)21-16-6-5-12(2)13(3)9-16/h5-6,9-11H,4,7-8H2,1-3H3/q-1