[9-[(4-chlorophenyl)methyl]-1,2,3,4-tetrahydrocarbazol-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [9-[(4-chlorophenyl)methyl]-1,2,3,4-tetrahydrocarbazol-3-yl] 4-methylbenzenesulfonate Openeye Name: [9-[(4-chlorophenyl)methyl]-1,2,3,4-tetrahydrocarbazol-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [9-[(4-chlorophenyl)methyl]-1,2,3,4-tetrahydrocarbazol-3-yl] ester IUPAC Name: [9-[(4-chlorophenyl)methyl]-1,2,3,4-tetrahydrocarbazol-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [9-(4-chlorobenzyl)-1,2,3,4-tetrahydrocarbazol-3-yl] ester Formula: C26H24ClNO3S MolecularWeight: 465.99166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CCC3=C(C2)C4=CC=CC=C4N3CC5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CCC3=C(C2)C4=CC=CC=C4N3CC5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H24ClNO3S/c1-18-6-13-22(14-7-18)32(29,30)31-21-12-15-26-24(16-21)23-4-2-3-5-25(23)28(26)17-19-8-10-20(27)11-9-19/h2-11,13-14,21H,12,15-17H2,1H3