3-(5-chloranyl-1-methyl-indol-3-yl)propanoic acid

Systemtic Name: 3-(5-chloranyl-1-methyl-indol-3-yl)propanoic acid Openeye Name: 3-(5-chloro-1-methyl-indol-3-yl)propanoic acid CAS Name: 3-(5-chloro-1-methyl-3-indolyl)propanoic acid IUPAC Name: 3-(5-chloro-1-methylindol-3-yl)propanoic acid Traditional Name: 3-(5-chloro-1-methyl-indol-3-yl)propionic acid Formula: C12H12ClNO2 MolecularWeight: 237.68218

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)Cl)CCC(=O)O

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)Cl)CCC(=O)O

InChI

InChI=1S/C12H12ClNO2/c1-14-7-8(2-5-12(15)16)10-6-9(13)3-4-11(10)14/h3-4,6-7H,2,5H2,1H3,(H,15,16)