9,10-dihydrophenanthren-1-ylmethyl 4-methylbenzenesulfonate

Systemtic Name: 9,10-dihydrophenanthren-1-ylmethyl 4-methylbenzenesulfonate Openeye Name: 9,10-dihydrophenanthren-1-ylmethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 9,10-dihydrophenanthren-1-ylmethyl ester IUPAC Name: 9,10-dihydrophenanthren-1-ylmethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 9,10-dihydrophenanthren-1-ylmethyl ester Formula: C22H20O3S MolecularWeight: 364.4574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2=CC=CC3=C2CCC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2=CC=CC3=C2CCC4=CC=CC=C43

InChI

InChI=1S/C22H20O3S/c1-16-9-12-19(13-10-16)26(23,24)25-15-18-6-4-8-22-20-7-3-2-5-17(20)11-14-21(18)22/h2-10,12-13H,11,14-15H2,1H3