3-(6-fluoranyl-1H-indol-3-yl)propyl 4-methylbenzenesulfonate

Systemtic Name: 3-(6-fluoranyl-1H-indol-3-yl)propyl 4-methylbenzenesulfonate Openeye Name: 3-(6-fluoro-1H-indol-3-yl)propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-(6-fluoro-1H-indol-3-yl)propyl ester IUPAC Name: 3-(6-fluoro-1H-indol-3-yl)propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-(6-fluoro-1H-indol-3-yl)propyl ester Formula: C18H18FNO3S MolecularWeight: 347.403823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2=CNC3=C2C=CC(=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2=CNC3=C2C=CC(=C3)F

InChI

InChI=1S/C18H18FNO3S/c1-13-4-7-16(8-5-13)24(21,22)23-10-2-3-14-12-20-18-11-15(19)6-9-17(14)18/h4-9,11-12,20H,2-3,10H2,1H3