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

Systemtic Name: 4-(1H-indol-3-yl)butyl 4-methylbenzenesulfonate Openeye Name: 4-(1H-indol-3-yl)butyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 4-(1H-indol-3-yl)butyl ester IUPAC Name: 4-(1H-indol-3-yl)butyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 4-(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)OCCCCC2=CNC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C19H21NO3S/c1-15-9-11-17(12-10-15)24(21,22)23-13-5-4-6-16-14-20-19-8-3-2-7-18(16)19/h2-3,7-12,14,20H,4-6,13H2,1H3