[2-(2-chloranylphenothiazin-10-yl)-2-oxidanylidene-ethyl] 3-(furan-2-yl)propanoate

Systemtic Name: [2-(2-chloranylphenothiazin-10-yl)-2-oxidanylidene-ethyl] 3-(furan-2-yl)propanoate Openeye Name: [2-(2-chlorophenothiazin-10-yl)-2-oxo-ethyl] 3-(2-furyl)propanoate CAS Name: 3-(2-furanyl)propanoic acid [2-(2-chloro-10-phenothiazinyl)-2-oxoethyl] ester IUPAC Name: [2-(2-chlorophenothiazin-10-yl)-2-oxoethyl] 3-(furan-2-yl)propanoate Traditional Name: 3-(2-furyl)propionic acid [2-(2-chlorophenothiazin-10-yl)-2-keto-ethyl] ester Formula: C21H16ClNO4S MolecularWeight: 413.87404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=C(S2)C=CC(=C3)Cl)C(=O)COC(=O)CCC4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=C(S2)C=CC(=C3)Cl)C(=O)COC(=O)CCC4=CC=CO4

InChI

InChI=1S/C21H16ClNO4S/c22-14-7-9-19-17(12-14)23(16-5-1-2-6-18(16)28-19)20(24)13-27-21(25)10-8-15-4-3-11-26-15/h1-7,9,11-12H,8,10,13H2