2-[7-chloranyl-2-(phenylcarbonyl)-1H-indol-3-yl]propanedioate

Systemtic Name: 2-[7-chloranyl-2-(phenylcarbonyl)-1H-indol-3-yl]propanedioate Openeye Name: 2-(2-benzoyl-7-chloro-1H-indol-3-yl)propanedioate CAS Name: 2-(2-benzoyl-7-chloro-1H-indol-3-yl)propanedioate IUPAC Name: 2-(2-benzoyl-7-chloro-1H-indol-3-yl)propanedioate Traditional Name: 2-(2-benzoyl-7-chloro-1H-indol-3-yl)malonate Formula: C18H10ClNO5-2 MolecularWeight: 355.7287

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C3=C(N2)C(=CC=C3)Cl)C(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C3=C(N2)C(=CC=C3)Cl)C(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C18H12ClNO5/c19-11-8-4-7-10-12(13(17(22)23)18(24)25)15(20-14(10)11)16(21)9-5-2-1-3-6-9/h1-8,13,20H,(H,22,23)(H,24,25)/p-2