(4-bromanyl-2,7-dimethoxy-5-oxidanylidene-10H-phenothiazin-3-yl) ethanoate

Systemtic Name: (4-bromanyl-2,7-dimethoxy-5-oxidanylidene-10H-phenothiazin-3-yl) ethanoate Openeye Name: (4-bromo-2,7-dimethoxy-5-oxo-10H-phenothiazin-3-yl) acetate CAS Name: acetic acid (4-bromo-2,7-dimethoxy-5-oxo-10H-phenothiazin-3-yl) ester IUPAC Name: (4-bromo-2,7-dimethoxy-5-oxo-10H-phenothiazin-3-yl) acetate Traditional Name: acetic acid (4-bromo-5-keto-2,7-dimethoxy-10H-phenothiazin-3-yl) ester Formula: C16H14BrNO5S MolecularWeight: 412.25506

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C2C(=C1Br)S(=O)C3=C(N2)C=CC(=C3)OC)OC

Isomeric SMILES

CC(=O)OC1=C(C=C2C(=C1Br)S(=O)C3=C(N2)C=CC(=C3)OC)OC

InChI

InChI=1S/C16H14BrNO5S/c1-8(19)23-15-12(22-3)7-11-16(14(15)17)24(20)13-6-9(21-2)4-5-10(13)18-11/h4-7,18H,1-3H3