[4-(2-phenylindolizin-3-yl)carbonylphenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-(2-phenylindolizin-3-yl)carbonylphenyl] 4-methylbenzenesulfonate Openeye Name: [4-(2-phenylindolizine-3-carbonyl)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-[oxo-(2-phenyl-3-indolizinyl)methyl]phenyl] ester IUPAC Name: [4-(2-phenylindolizine-3-carbonyl)phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-(2-phenylindolizine-3-carbonyl)phenyl] ester Formula: C28H21NO4S MolecularWeight: 467.53564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(=O)C3=C(C=C4N3C=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(=O)C3=C(C=C4N3C=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H21NO4S/c1-20-10-16-25(17-11-20)34(31,32)33-24-14-12-22(13-15-24)28(30)27-26(21-7-3-2-4-8-21)19-23-9-5-6-18-29(23)27/h2-19H,1H3