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

Systemtic Name: [4-bromanyl-2,7-dimethoxy-5,5-bis(oxidanylidene)-10H-phenothiazin-3-yl] ethanoate Openeye Name: (4-bromo-2,7-dimethoxy-5,5-dioxo-10H-phenothiazin-3-yl) acetate CAS Name: acetic acid (4-bromo-2,7-dimethoxy-5,5-dioxo-10H-phenothiazin-3-yl) ester IUPAC Name: (4-bromo-2,7-dimethoxy-5,5-dioxo-10H-phenothiazin-3-yl) acetate Traditional Name: acetic acid (4-bromo-5,5-diketo-2,7-dimethoxy-10H-phenothiazin-3-yl) ester Formula: C16H14BrNO6S MolecularWeight: 428.25446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrNO6S/c1-8(19)24-15-12(23-3)7-11-16(14(15)17)25(20,21)13-6-9(22-2)4-5-10(13)18-11/h4-7,18H,1-3H3