3-(1-methylindol-3-yl)propyl 4-methylbenzenesulfonate

Systemtic Name: 3-(1-methylindol-3-yl)propyl 4-methylbenzenesulfonate Openeye Name: 3-(1-methylindol-3-yl)propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-(1-methyl-3-indolyl)propyl ester IUPAC Name: 3-(1-methylindol-3-yl)propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-(1-methylindol-3-yl)propyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2=CN(C3=CC=CC=C32)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2=CN(C3=CC=CC=C32)C

InChI

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