propyl 2-(5-methoxy-1H-indol-3-yl)-4-methyl-benzenesulfonate

Systemtic Name: propyl 2-(5-methoxy-1H-indol-3-yl)-4-methyl-benzenesulfonate Openeye Name: propyl 2-(5-methoxy-1H-indol-3-yl)-4-methyl-benzenesulfonate CAS Name: 2-(5-methoxy-1H-indol-3-yl)-4-methylbenzenesulfonic acid propyl ester IUPAC Name: propyl 2-(5-methoxy-1H-indol-3-yl)-4-methylbenzenesulfonate Traditional Name: 2-(5-methoxy-1H-indol-3-yl)-4-methyl-benzenesulfonic acid propyl ester Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

CCCOS(=O)(=O)C1=C(C=C(C=C1)C)C2=CNC3=C2C=C(C=C3)OC

Isomeric SMILES

CCCOS(=O)(=O)C1=C(C=C(C=C1)C)C2=CNC3=C2C=C(C=C3)OC

InChI

InChI=1S/C19H21NO4S/c1-4-9-24-25(21,22)19-8-5-13(2)10-16(19)17-12-20-18-7-6-14(23-3)11-15(17)18/h5-8,10-12,20H,4,9H2,1-3H3