[(2S)-1-(2-chloranylphenothiazin-10-yl)-1-oxidanylidene-propan-2-yl] 2,4-dimethyl-6-oxidanylidene-pyran-3-carboxylate

Systemtic Name: [(2S)-1-(2-chloranylphenothiazin-10-yl)-1-oxidanylidene-propan-2-yl] 2,4-dimethyl-6-oxidanylidene-pyran-3-carboxylate Openeye Name: [(1S)-2-(2-chlorophenothiazin-10-yl)-1-methyl-2-oxo-ethyl] 2,4-dimethyl-6-oxo-pyran-3-carboxylate CAS Name: 2,4-dimethyl-6-oxo-3-pyrancarboxylic acid [(2S)-1-(2-chloro-10-phenothiazinyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-chlorophenothiazin-10-yl)-1-oxopropan-2-yl] 2,4-dimethyl-6-oxopyran-3-carboxylate Traditional Name: 6-keto-2,4-dimethyl-pyran-3-carboxylic acid [(1S)-2-(2-chlorophenothiazin-10-yl)-2-keto-1-methyl-ethyl] ester Formula: C23H18ClNO5S MolecularWeight: 455.91072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC(=C1C(=O)OC(C)C(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC(=O)OC(=C1C(=O)O[C@@H](C)C(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)C

InChI

InChI=1S/C23H18ClNO5S/c1-12-10-20(26)29-13(2)21(12)23(28)30-14(3)22(27)25-16-6-4-5-7-18(16)31-19-9-8-15(24)11-17(19)25/h4-11,14H,1-3H3/t14-/m0/s1