1-[3-(5-oxidanylidenephenothiazin-10-yl)propyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[3-(5-oxidanylidenephenothiazin-10-yl)propyl]piperidine-3-carboxylic acid Openeye Name: 1-[3-(5-oxophenothiazin-10-yl)propyl]piperidine-3-carboxylic acid CAS Name: 1-[3-(5-oxo-10-phenothiazinyl)propyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[3-(5-oxophenothiazin-10-yl)propyl]piperidine-3-carboxylic acid Traditional Name: 1-[3-(5-ketophenothiazin-10-yl)propyl]nipecotic acid Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCCN2C3=CC=CC=C3S(=O)C4=CC=CC=C42)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CCCN2C3=CC=CC=C3S(=O)C4=CC=CC=C42)C(=O)O

InChI

InChI=1S/C21H24N2O3S/c24-21(25)16-7-5-12-22(15-16)13-6-14-23-17-8-1-3-10-19(17)27(26)20-11-4-2-9-18(20)23/h1-4,8-11,16H,5-7,12-15H2,(H,24,25)