4-(10-methyl-2-oxidanyl-phenothiazin-1-yl)carbonylbenzoic acid

Systemtic Name: 4-(10-methyl-2-oxidanyl-phenothiazin-1-yl)carbonylbenzoic acid Openeye Name: 4-(2-hydroxy-10-methyl-phenothiazine-1-carbonyl)benzoic acid CAS Name: 4-[(2-hydroxy-10-methyl-1-phenothiazinyl)-oxomethyl]benzoic acid IUPAC Name: 4-(2-hydroxy-10-methylphenothiazine-1-carbonyl)benzoic acid Traditional Name: 4-(2-hydroxy-10-methyl-phenothiazine-1-carbonyl)benzoic acid Formula: C21H15NO4S MolecularWeight: 377.4131

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC3=C1C(=C(C=C3)O)C(=O)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CN1C2=CC=CC=C2SC3=C1C(=C(C=C3)O)C(=O)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C21H15NO4S/c1-22-14-4-2-3-5-16(14)27-17-11-10-15(23)18(19(17)22)20(24)12-6-8-13(9-7-12)21(25)26/h2-11,23H,1H3,(H,25,26)