4-fluoranyl-3-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethyl]-1H-indole-7-carboxylic acid

Systemtic Name: 4-fluoranyl-3-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethyl]-1H-indole-7-carboxylic acid Openeye Name: 3-[2-(4-benzoylpiperazin-1-yl)-2-oxo-ethyl]-4-fluoro-1H-indole-7-carboxylic acid CAS Name: 3-[2-(4-benzoyl-1-piperazinyl)-2-oxoethyl]-4-fluoro-1H-indole-7-carboxylic acid IUPAC Name: 3-[2-(4-benzoylpiperazin-1-yl)-2-oxoethyl]-4-fluoro-1H-indole-7-carboxylic acid Traditional Name: 3-[2-(4-benzoylpiperazino)-2-keto-ethyl]-4-fluoro-1H-indole-7-carboxylic acid Formula: C22H20FN3O4 MolecularWeight: 409.410303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CNC3=C(C=CC(=C23)F)C(=O)O)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CNC3=C(C=CC(=C23)F)C(=O)O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20FN3O4/c23-17-7-6-16(22(29)30)20-19(17)15(13-24-20)12-18(27)25-8-10-26(11-9-25)21(28)14-4-2-1-3-5-14/h1-7,13,24H,8-12H2,(H,29,30)