[3-ethanoyl-1-(phenylmethyl)indol-2-yl] benzenesulfonate

Systemtic Name: [3-ethanoyl-1-(phenylmethyl)indol-2-yl] benzenesulfonate Openeye Name: (3-acetyl-1-benzyl-indol-2-yl) benzenesulfonate CAS Name: benzenesulfonic acid [3-acetyl-1-(phenylmethyl)-2-indolyl] ester IUPAC Name: (3-acetyl-1-benzylindol-2-yl) benzenesulfonate Traditional Name: benzenesulfonic acid (3-acetyl-1-benzyl-indol-2-yl) ester Formula: C23H19NO4S MolecularWeight: 405.46626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3)OS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3)OS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H19NO4S/c1-17(25)22-20-14-8-9-15-21(20)24(16-18-10-4-2-5-11-18)23(22)28-29(26,27)19-12-6-3-7-13-19/h2-15H,16H2,1H3