3-[1-(3-thioxanthen-9-ylidenepropyl)piperidin-4-yl]propanoic acid

Systemtic Name: 3-[1-(3-thioxanthen-9-ylidenepropyl)piperidin-4-yl]propanoic acid Openeye Name: 3-[1-(3-thioxanthen-9-ylidenepropyl)-4-piperidyl]propanoic acid CAS Name: 3-[1-[3-(9-thioxanthenylidene)propyl]-4-piperidinyl]propanoic acid IUPAC Name: 3-[1-(3-thioxanthen-9-ylidenepropyl)piperidin-4-yl]propanoic acid Traditional Name: 3-[1-(3-thioxanthen-9-ylidenepropyl)-4-piperidyl]propionic acid Formula: C24H27NO2S MolecularWeight: 393.54168

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC(=O)O)CCC=C2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

C1CN(CCC1CCC(=O)O)CCC=C2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C24H27NO2S/c26-24(27)12-11-18-13-16-25(17-14-18)15-5-8-19-20-6-1-3-9-22(20)28-23-10-4-2-7-21(19)23/h1-4,6-10,18H,5,11-17H2,(H,26,27)