2-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitro-benzaldehyde

Systemtic Name: 2-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitro-benzaldehyde Openeye Name: 2-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitro-benzaldehyde CAS Name: 2-[4-(2-fluorophenyl)-1-piperazinyl]-5-nitrobenzaldehyde IUPAC Name: 2-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitrobenzaldehyde Traditional Name: 2-[4-(2-fluorophenyl)piperazino]-5-nitro-benzaldehyde Formula: C17H16FN3O3 MolecularWeight: 329.325643

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C=O)C3=CC=CC=C3F

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C=O)C3=CC=CC=C3F

InChI

InChI=1S/C17H16FN3O3/c18-15-3-1-2-4-17(15)20-9-7-19(8-10-20)16-6-5-14(21(23)24)11-13(16)12-22/h1-6,11-12H,7-10H2