1-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperidine-3-carboxylic acid Openeye Name: 1-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperidine-3-carboxylic acid CAS Name: 1-[3-[2-(trifluoromethyl)-10-phenothiazinyl]propyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperidine-3-carboxylic acid Traditional Name: 1-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]nipecotic acid Formula: C22H23F3N2O2S MolecularWeight: 436.49043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)C(=O)O

InChI

InChI=1S/C22H23F3N2O2S/c23-22(24,25)16-8-9-20-18(13-16)27(17-6-1-2-7-19(17)30-20)12-4-11-26-10-3-5-15(14-26)21(28)29/h1-2,6-9,13,15H,3-5,10-12,14H2,(H,28,29)