(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate CAS Name: 1-(2,2-dimethyl-1-oxopropyl)-4-piperidinecarboxylic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate Traditional Name: 1-pivaloylisonipecotic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCC(CC1)C(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

CC(C)(C)C(=O)N1CCC(CC1)C(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C25H28N2O4S/c1-25(2,3)24(30)26-14-12-17(13-15-26)23(29)31-16-22(28)27-18-8-4-6-10-20(18)32-21-11-7-5-9-19(21)27/h4-11,17H,12-16H2,1-3H3