[4-(1H-indol-2-yl)-2-prop-2-ynoxy-phenyl] benzenesulfonate

Systemtic Name: [4-(1H-indol-2-yl)-2-prop-2-ynoxy-phenyl] benzenesulfonate Openeye Name: [4-(1H-indol-2-yl)-2-prop-2-ynoxy-phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [4-(1H-indol-2-yl)-2-prop-2-ynoxyphenyl] ester IUPAC Name: [4-(1H-indol-2-yl)-2-prop-2-ynoxyphenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [4-(1H-indol-2-yl)-2-propargyloxy-phenyl] ester Formula: C23H17NO4S MolecularWeight: 403.45038

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=C(C=CC(=C1)C2=CC3=CC=CC=C3N2)OS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C#CCOC1=C(C=CC(=C1)C2=CC3=CC=CC=C3N2)OS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H17NO4S/c1-2-14-27-23-16-18(21-15-17-8-6-7-11-20(17)24-21)12-13-22(23)28-29(25,26)19-9-4-3-5-10-19/h1,3-13,15-16,24H,14H2