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4-[5-chloranyl-1-(1-methylimidazol-4-yl)sulfonyl-indol-2-yl]butanoic acid

4-[5-chloranyl-1-(1-methylimidazol-4-yl)sulfonyl-indol-2-yl]butanoic acid

Systemtic Name:4-[5-chloranyl-1-(1-methylimidazol-4-yl)sulfonyl-indol-2-yl]butanoic acid
Openeye Name:4-[5-chloro-1-(1-methylimidazol-4-yl)sulfonyl-indol-2-yl]butanoic acid
CAS Name:4-[5-chloro-1-[(1-methyl-4-imidazolyl)sulfonyl]-2-indolyl]butanoic acid
IUPAC Name:4-[5-chloro-1-(1-methylimidazol-4-yl)sulfonylindol-2-yl]butanoic acid
Traditional Name:4-[5-chloro-1-(1-methylimidazol-4-yl)sulfonyl-indol-2-yl]butyric acid
Formula: C16H16ClN3O4S
MolecularWeight: 381.83394
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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)S(=O)(=O)N2C3=C(C=C(C=C3)Cl)C=C2CCCC(=O)O


Isomeric SMILES

CN1C=C(N=C1)S(=O)(=O)N2C3=C(C=C(C=C3)Cl)C=C2CCCC(=O)O


InChI

InChI=1S/C16H16ClN3O4S/c1-19-9-15(18-10-19)25(23,24)20-13(3-2-4-16(21)22)8-11-7-12(17)5-6-14(11)20/h5-10H,2-4H2,1H3,(H,21,22)


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