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3-(2-chloranyl-7-oxidanyl-phenothiazin-10-yl)propanoic acid

3-(2-chloranyl-7-oxidanyl-phenothiazin-10-yl)propanoic acid

Systemtic Name:3-(2-chloranyl-7-oxidanyl-phenothiazin-10-yl)propanoic acid
Openeye Name:3-(2-chloro-7-hydroxy-phenothiazin-10-yl)propanoic acid
CAS Name:3-(2-chloro-7-hydroxy-10-phenothiazinyl)propanoic acid
IUPAC Name:3-(2-chloro-7-hydroxyphenothiazin-10-yl)propanoic acid
Traditional Name:3-(2-chloro-7-hydroxy-phenothiazin-10-yl)propionic acid
Formula: C15H12ClNO3S
MolecularWeight: 321.77868
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)SC3=C(N2CCC(=O)O)C=C(C=C3)Cl


Isomeric SMILES

C1=CC2=C(C=C1O)SC3=C(N2CCC(=O)O)C=C(C=C3)Cl


InChI

InChI=1S/C15H12ClNO3S/c16-9-1-4-13-12(7-9)17(6-5-15(19)20)11-3-2-10(18)8-14(11)21-13/h1-4,7-8,18H,5-6H2,(H,19,20)


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