1,2,3,4-tetrahydroquinolin-5-yl 4-methylbenzenesulfonate

Systemtic Name: 1,2,3,4-tetrahydroquinolin-5-yl 4-methylbenzenesulfonate Openeye Name: 1,2,3,4-tetrahydroquinolin-5-yl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 1,2,3,4-tetrahydroquinolin-5-yl ester IUPAC Name: 1,2,3,4-tetrahydroquinolin-5-yl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 1,2,3,4-tetrahydroquinolin-5-yl ester Formula: C16H17NO3S MolecularWeight: 303.37608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2CCCN3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2CCCN3

InChI

InChI=1S/C16H17NO3S/c1-12-7-9-13(10-8-12)21(18,19)20-16-6-2-5-15-14(16)4-3-11-17-15/h2,5-10,17H,3-4,11H2,1H3