3-[4-(6-bromanylimidazo[1,2-a]pyridin-2-yl)phenoxy]propyl 4-methylbenzenesulfonate

Systemtic Name: 3-[4-(6-bromanylimidazo[1,2-a]pyridin-2-yl)phenoxy]propyl 4-methylbenzenesulfonate Openeye Name: 3-[4-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenoxy]propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-[4-(6-bromo-2-imidazo[1,2-a]pyridinyl)phenoxy]propyl ester IUPAC Name: 3-[4-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenoxy]propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-[4-(6-bromoimidazo[1,2-a]pyridin-2-yl)phenoxy]propyl ester Formula: C23H21BrN2O4S MolecularWeight: 501.39284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCOC2=CC=C(C=C2)C3=CN4C=C(C=CC4=N3)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCOC2=CC=C(C=C2)C3=CN4C=C(C=CC4=N3)Br

InChI

InChI=1S/C23H21BrN2O4S/c1-17-3-10-21(11-4-17)31(27,28)30-14-2-13-29-20-8-5-18(6-9-20)22-16-26-15-19(24)7-12-23(26)25-22/h3-12,15-16H,2,13-14H2,1H3