1-acetyloxyethyl 4-bromanyl-2,7-dimethoxy-3-oxidanyl-phenothiazine-10-carboxylate

Systemtic Name: 1-acetyloxyethyl 4-bromanyl-2,7-dimethoxy-3-oxidanyl-phenothiazine-10-carboxylate Openeye Name: 1-acetoxyethyl 4-bromo-3-hydroxy-2,7-dimethoxy-phenothiazine-10-carboxylate CAS Name: 4-bromo-3-hydroxy-2,7-dimethoxy-10-phenothiazinecarboxylic acid 1-acetyloxyethyl ester IUPAC Name: 1-acetyloxyethyl 4-bromo-3-hydroxy-2,7-dimethoxyphenothiazine-10-carboxylate Traditional Name: 4-bromo-3-hydroxy-2,7-dimethoxy-phenothiazine-10-carboxylic acid 1-acetoxyethyl ester Formula: C19H18BrNO7S MolecularWeight: 484.31772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(OC(=O)C)OC(=O)N1C2=C(C=C(C=C2)OC)SC3=C(C(=C(C=C31)OC)O)Br

Isomeric SMILES

CC(OC(=O)C)OC(=O)N1C2=C(C=C(C=C2)OC)SC3=C(C(=C(C=C31)OC)O)Br

InChI

InChI=1S/C19H18BrNO7S/c1-9(22)27-10(2)28-19(24)21-12-6-5-11(25-3)7-15(12)29-18-13(21)8-14(26-4)17(23)16(18)20/h5-8,10,23H,1-4H3