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1-[3-(5-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)propyl]pyrrole-2-carboxylic acid

1-[3-(5-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)propyl]pyrrole-2-carboxylic acid

Systemtic Name:1-[3-(5-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)propyl]pyrrole-2-carboxylic acid
Openeye Name:1-[3-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)propyl]pyrrole-2-carboxylic acid
CAS Name:1-[3-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)propyl]-2-pyrrolecarboxylic acid
IUPAC Name:1-[3-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)propyl]pyrrole-2-carboxylic acid
Traditional Name:1-[3-(5-chloro-2-keto-1,3-benzothiazol-3-yl)propyl]pyrrole-2-carboxylic acid
Formula: C15H13ClN2O3S
MolecularWeight: 336.79332
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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)C(=O)O)CCCN2C3=C(C=CC(=C3)Cl)SC2=O


Isomeric SMILES

C1=CN(C(=C1)C(=O)O)CCCN2C3=C(C=CC(=C3)Cl)SC2=O


InChI

InChI=1S/C15H13ClN2O3S/c16-10-4-5-13-12(9-10)18(15(21)22-13)8-2-7-17-6-1-3-11(17)14(19)20/h1,3-6,9H,2,7-8H2,(H,19,20)


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