4-(3-phenylsulfanyl-1H-indol-7-yl)piperidine-1-carboxylic acid

Systemtic Name: 4-(3-phenylsulfanyl-1H-indol-7-yl)piperidine-1-carboxylic acid Openeye Name: 4-(3-phenylsulfanyl-1H-indol-7-yl)piperidine-1-carboxylic acid CAS Name: 4-[3-(phenylthio)-1H-indol-7-yl]-1-piperidinecarboxylic acid IUPAC Name: 4-(3-phenylsulfanyl-1H-indol-7-yl)piperidine-1-carboxylic acid Traditional Name: 4-[3-(phenylthio)-1H-indol-7-yl]piperidine-1-carboxylic acid Formula: C20H20N2O2S MolecularWeight: 352.45

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=CC3=C2NC=C3SC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CN(CCC1C2=CC=CC3=C2NC=C3SC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C20H20N2O2S/c23-20(24)22-11-9-14(10-12-22)16-7-4-8-17-18(13-21-19(16)17)25-15-5-2-1-3-6-15/h1-8,13-14,21H,9-12H2,(H,23,24)