10-[[(2-chlorophenyl)amino]methyl]-7-methoxy-phenothiazine-1-carboxylic acid

Systemtic Name: 10-[[(2-chlorophenyl)amino]methyl]-7-methoxy-phenothiazine-1-carboxylic acid Openeye Name: 10-[(2-chloroanilino)methyl]-7-methoxy-phenothiazine-1-carboxylic acid CAS Name: 10-[(2-chloroanilino)methyl]-7-methoxy-1-phenothiazinecarboxylic acid IUPAC Name: 10-[(2-chloroanilino)methyl]-7-methoxyphenothiazine-1-carboxylic acid Traditional Name: 10-[(2-chloroanilino)methyl]-7-methoxy-phenothiazine-1-carboxylic acid Formula: C21H17ClN2O3S MolecularWeight: 412.88928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C3=C(C=CC=C3S2)C(=O)O)CNC4=CC=CC=C4Cl

Isomeric SMILES

COC1=CC2=C(C=C1)N(C3=C(C=CC=C3S2)C(=O)O)CNC4=CC=CC=C4Cl

InChI

InChI=1S/C21H17ClN2O3S/c1-27-13-9-10-17-19(11-13)28-18-8-4-5-14(21(25)26)20(18)24(17)12-23-16-7-3-2-6-15(16)22/h2-11,23H,12H2,1H3,(H,25,26)