3,4-dihydro-2H-pyrano[2,3-f]quinolin-2-ylmethyl 4-methylbenzenesulfonate

Systemtic Name: 3,4-dihydro-2H-pyrano[2,3-f]quinolin-2-ylmethyl 4-methylbenzenesulfonate Openeye Name: 3,4-dihydro-2H-pyrano[2,3-f]quinolin-2-ylmethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3,4-dihydro-2H-pyrano[2,3-f]quinolin-2-ylmethyl ester IUPAC Name: 3,4-dihydro-2H-pyrano[2,3-f]quinolin-2-ylmethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3,4-dihydro-2H-pyrano[2,3-f]quinolin-2-ylmethyl ester Formula: C20H19NO4S MolecularWeight: 369.43416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCC3=C(O2)C4=C(C=C3)N=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCC3=C(O2)C4=C(C=C3)N=CC=C4

InChI

InChI=1S/C20H19NO4S/c1-14-4-9-17(10-5-14)26(22,23)24-13-16-8-6-15-7-11-19-18(20(15)25-16)3-2-12-21-19/h2-5,7,9-12,16H,6,8,13H2,1H3