(1-oxidanylidene-2,5-dihydrocyclopenta[a]phenanthren-11-yl) 4-methylbenzenesulfonate

Systemtic Name: (1-oxidanylidene-2,5-dihydrocyclopenta[a]phenanthren-11-yl) 4-methylbenzenesulfonate Openeye Name: (1-oxo-2,5-dihydrocyclopenta[a]phenanthren-11-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (1-oxo-2,5-dihydrocyclopenta[a]phenanthren-11-yl) ester IUPAC Name: (1-oxo-2,5-dihydrocyclopenta[a]phenanthren-11-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-keto-2,5-dihydrocyclopenta[a]phenanthren-11-yl) ester Formula: C24H18O4S MolecularWeight: 402.46232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=CC=CC3=C4C2=C5C(C=CCC5=O)C=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=CC=CC3=C4C2=C5C(C=CCC5=O)C=C4

InChI

InChI=1S/C24H18O4S/c1-15-8-11-18(12-9-15)29(26,27)28-22-14-17-5-2-6-19(17)20-13-10-16-4-3-7-21(25)23(16)24(20)22/h2-6,8-14,16H,7H2,1H3