5-bromanyl-N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-2-ethoxy-benzenesulfonamide

Systemtic Name: 5-bromanyl-N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-2-ethoxy-benzenesulfonamide Openeye Name: 5-bromo-N-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]-2-ethoxy-benzenesulfonamide CAS Name: 5-bromo-N-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]-2-ethoxybenzenesulfonamide IUPAC Name: 5-bromo-N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-2-ethoxybenzenesulfonamide Traditional Name: 5-bromo-N-[4-(2,6-dimethylpiperidino)sulfonylphenyl]-2-ethoxy-benzenesulfonamide Formula: C21H27BrN2O5S2 MolecularWeight: 531.48348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N3C(CCCC3C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N3C(CCCC3C)C

InChI

InChI=1S/C21H27BrN2O5S2/c1-4-29-20-13-8-17(22)14-21(20)30(25,26)23-18-9-11-19(12-10-18)31(27,28)24-15(2)6-5-7-16(24)3/h8-16,23H,4-7H2,1-3H3