2-[(1S)-1-(2-chloranyl-6-fluoranyl-phenyl)-2-nitro-ethyl]-3-oxidanylidene-inden-1-olate

Systemtic Name: 2-[(1S)-1-(2-chloranyl-6-fluoranyl-phenyl)-2-nitro-ethyl]-3-oxidanylidene-inden-1-olate Openeye Name: 2-[(1S)-1-(2-chloro-6-fluoro-phenyl)-2-nitro-ethyl]-3-oxo-inden-1-olate CAS Name: 2-[(1S)-1-(2-chloro-6-fluorophenyl)-2-nitroethyl]-3-oxo-1-indenolate IUPAC Name: 2-[(1S)-1-(2-chloro-6-fluorophenyl)-2-nitroethyl]-3-oxoinden-1-olate Traditional Name: 2-[(1S)-1-(2-chloro-6-fluoro-phenyl)-2-nitro-ethyl]-3-keto-inden-1-olate Formula: C17H10ClFNO4- MolecularWeight: 346.717003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C2=O)C(C[N+](=O)[O-])C3=C(C=CC=C3Cl)F)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C2=O)[C@H](C[N+](=O)[O-])C3=C(C=CC=C3Cl)F)[O-]

InChI

InChI=1S/C17H11ClFNO4/c18-12-6-3-7-13(19)14(12)11(8-20(23)24)15-16(21)9-4-1-2-5-10(9)17(15)22/h1-7,11,21H,8H2/p-1/t11-/m1/s1