2-(3-chloranylpropyl)-1-oxidanyl-indole-3-carboxylate

Systemtic Name: 2-(3-chloranylpropyl)-1-oxidanyl-indole-3-carboxylate Openeye Name: 2-(3-chloropropyl)-1-hydroxy-indole-3-carboxylate CAS Name: 2-(3-chloropropyl)-1-hydroxy-3-indolecarboxylate IUPAC Name: 2-(3-chloropropyl)-1-hydroxyindole-3-carboxylate Traditional Name: 2-(3-chloropropyl)-1-hydroxy-indole-3-carboxylate Formula: C12H11ClNO3- MolecularWeight: 252.67364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2O)CCCCl)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2O)CCCCl)C(=O)[O-]

InChI

InChI=1S/C12H12ClNO3/c13-7-3-6-10-11(12(15)16)8-4-1-2-5-9(8)14(10)17/h1-2,4-5,17H,3,6-7H2,(H,15,16)/p-1