3-(5-piperidin-1-ylsulfonylindol-1-yl)propanoic acid

Systemtic Name: 3-(5-piperidin-1-ylsulfonylindol-1-yl)propanoic acid Openeye Name: 3-[5-(1-piperidylsulfonyl)indol-1-yl]propanoic acid CAS Name: 3-[5-(1-piperidinylsulfonyl)-1-indolyl]propanoic acid IUPAC Name: 3-(5-piperidin-1-ylsulfonylindol-1-yl)propanoic acid Traditional Name: 3-(5-piperidinosulfonylindol-1-yl)propionic acid Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C=C3)CCC(=O)O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C=C3)CCC(=O)O

InChI

InChI=1S/C16H20N2O4S/c19-16(20)7-11-17-10-6-13-12-14(4-5-15(13)17)23(21,22)18-8-2-1-3-9-18/h4-6,10,12H,1-3,7-9,11H2,(H,19,20)