3,4-dihydro-2H-quinolin-1-ylmethyl 4-methylbenzenesulfonate

Systemtic Name: 3,4-dihydro-2H-quinolin-1-ylmethyl 4-methylbenzenesulfonate Openeye Name: 3,4-dihydro-2H-quinolin-1-ylmethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3,4-dihydro-2H-quinolin-1-ylmethyl ester IUPAC Name: 3,4-dihydro-2H-quinolin-1-ylmethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3,4-dihydro-2H-quinolin-1-ylmethyl ester Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCN2CCCC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCN2CCCC3=CC=CC=C32

InChI

InChI=1S/C17H19NO3S/c1-14-8-10-16(11-9-14)22(19,20)21-13-18-12-4-6-15-5-2-3-7-17(15)18/h2-3,5,7-11H,4,6,12-13H2,1H3