5-bromanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-propanoyl-2,3-dihydroindole-7-sulfonamide

Systemtic Name: 5-bromanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-propanoyl-2,3-dihydroindole-7-sulfonamide Openeye Name: 5-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-propanoyl-indoline-7-sulfonamide CAS Name: 5-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(1-oxopropyl)-2,3-dihydroindole-7-sulfonamide IUPAC Name: 5-bromo-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-propanoyl-2,3-dihydroindole-7-sulfonamide Traditional Name: 5-bromo-N-homoveratryl-1-propionyl-indoline-7-sulfonamide Formula: C21H25BrN2O5S MolecularWeight: 497.4026

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)NCCC3=CC(=C(C=C3)OC)OC)Br

Isomeric SMILES

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)NCCC3=CC(=C(C=C3)OC)OC)Br

InChI

InChI=1S/C21H25BrN2O5S/c1-4-20(25)24-10-8-15-12-16(22)13-19(21(15)24)30(26,27)23-9-7-14-5-6-17(28-2)18(11-14)29-3/h5-6,11-13,23H,4,7-10H2,1-3H3