2-[2-[1-(phenylsulfonyl)indol-3-yl]ethyl]benzoic acid

Systemtic Name: 2-[2-[1-(phenylsulfonyl)indol-3-yl]ethyl]benzoic acid Openeye Name: 2-[2-[1-(benzenesulfonyl)indol-3-yl]ethyl]benzoic acid CAS Name: 2-[2-[1-(benzenesulfonyl)-3-indolyl]ethyl]benzoic acid IUPAC Name: 2-[2-[1-(benzenesulfonyl)indol-3-yl]ethyl]benzoic acid Traditional Name: 2-[2-(1-besylindol-3-yl)ethyl]benzoic acid Formula: C23H19NO4S MolecularWeight: 405.46626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CCC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CCC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C23H19NO4S/c25-23(26)21-12-5-4-8-17(21)14-15-18-16-24(22-13-7-6-11-20(18)22)29(27,28)19-9-2-1-3-10-19/h1-13,16H,14-15H2,(H,25,26)