[6-(4-chloranylphenoxy)-2,3,4,9-tetrahydro-1H-carbazol-3-yl] phenylmethanesulfonate

Systemtic Name: [6-(4-chloranylphenoxy)-2,3,4,9-tetrahydro-1H-carbazol-3-yl] phenylmethanesulfonate Openeye Name: [6-(4-chlorophenoxy)-2,3,4,9-tetrahydro-1H-carbazol-3-yl] phenylmethanesulfonate CAS Name: phenylmethanesulfonic acid [6-(4-chlorophenoxy)-2,3,4,9-tetrahydro-1H-carbazol-3-yl] ester IUPAC Name: [6-(4-chlorophenoxy)-2,3,4,9-tetrahydro-1H-carbazol-3-yl] phenylmethanesulfonate Traditional Name: phenylmethanesulfonic acid [6-(4-chlorophenoxy)-2,3,4,9-tetrahydro-1H-carbazol-3-yl] ester Formula: C25H22ClNO4S MolecularWeight: 467.96448

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1OS(=O)(=O)CC3=CC=CC=C3)C4=C(N2)C=CC(=C4)OC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CC2=C(CC1OS(=O)(=O)CC3=CC=CC=C3)C4=C(N2)C=CC(=C4)OC5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H22ClNO4S/c26-18-6-8-19(9-7-18)30-20-10-12-24-22(14-20)23-15-21(11-13-25(23)27-24)31-32(28,29)16-17-4-2-1-3-5-17/h1-10,12,14,21,27H,11,13,15-16H2