4-[1-(phenylsulfonyl)indol-7-yl]piperidine-1-carboxylic acid

Systemtic Name: 4-[1-(phenylsulfonyl)indol-7-yl]piperidine-1-carboxylic acid Openeye Name: 4-[1-(benzenesulfonyl)indol-7-yl]piperidine-1-carboxylic acid CAS Name: 4-[1-(benzenesulfonyl)-7-indolyl]-1-piperidinecarboxylic acid IUPAC Name: 4-[1-(benzenesulfonyl)indol-7-yl]piperidine-1-carboxylic acid Traditional Name: 4-(1-besylindol-7-yl)piperidine-1-carboxylic acid Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=CC3=C2N(C=C3)S(=O)(=O)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CN(CCC1C2=CC=CC3=C2N(C=C3)S(=O)(=O)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C20H20N2O4S/c23-20(24)21-12-9-15(10-13-21)18-8-4-5-16-11-14-22(19(16)18)27(25,26)17-6-2-1-3-7-17/h1-8,11,14-15H,9-10,12-13H2,(H,23,24)