3-(1H-indol-3-yl)butyl 4-methylbenzenesulfonate

Systemtic Name: 3-(1H-indol-3-yl)butyl 4-methylbenzenesulfonate Openeye Name: 3-(1H-indol-3-yl)butyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-(1H-indol-3-yl)butyl ester IUPAC Name: 3-(1H-indol-3-yl)butyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-(1H-indol-3-yl)butyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)C2=CNC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C19H21NO3S/c1-14-7-9-16(10-8-14)24(21,22)23-12-11-15(2)18-13-20-19-6-4-3-5-17(18)19/h3-10,13,15,20H,11-12H2,1-2H3