2-indol-1-ylethyl 4-methylbenzenesulfonate

Systemtic Name: 2-indol-1-ylethyl 4-methylbenzenesulfonate Openeye Name: 2-indol-1-ylethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-(1-indolyl)ethyl ester IUPAC Name: 2-indol-1-ylethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-indol-1-ylethyl ester Formula: C17H17NO3S MolecularWeight: 315.38678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCN2C=CC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCN2C=CC3=CC=CC=C32

InChI

InChI=1S/C17H17NO3S/c1-14-6-8-16(9-7-14)22(19,20)21-13-12-18-11-10-15-4-2-3-5-17(15)18/h2-11H,12-13H2,1H3