(E)-4-[5-chloranyl-1-(4-fluorophenyl)carbonyl-indol-3-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid

Systemtic Name: (E)-4-[5-chloranyl-1-(4-fluorophenyl)carbonyl-indol-3-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-[5-chloro-1-(4-fluorobenzoyl)indol-3-yl]-4-hydroxy-2-oxo-but-3-enoic acid CAS Name: (E)-4-[5-chloro-1-[(4-fluorophenyl)-oxomethyl]-3-indolyl]-4-hydroxy-2-oxo-3-butenoic acid IUPAC Name: (E)-4-[5-chloro-1-(4-fluorobenzoyl)indol-3-yl]-4-hydroxy-2-oxobut-3-enoic acid Traditional Name: (E)-4-[5-chloro-1-(4-fluorobenzoyl)indol-3-yl]-4-hydroxy-2-keto-but-3-enoic acid Formula: C19H11ClFNO5 MolecularWeight: 387.745743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)N2C=C(C3=C2C=CC(=C3)Cl)C(=CC(=O)C(=O)O)O)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)N2C=C(C3=C2C=CC(=C3)Cl)/C(=C\C(=O)C(=O)O)/O)F

InChI

InChI=1S/C19H11ClFNO5/c20-11-3-6-15-13(7-11)14(16(23)8-17(24)19(26)27)9-22(15)18(25)10-1-4-12(21)5-2-10/h1-9,23H,(H,26,27)/b16-8+