4-[4-(4-azanyl-5-nitro-pyridin-2-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one

Systemtic Name: 4-[4-(4-azanyl-5-nitro-pyridin-2-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one Openeye Name: 4-[4-(4-amino-5-nitro-2-pyridyl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one CAS Name: 4-[4-(4-amino-5-nitro-2-pyridinyl)-1-piperazinyl]-1-(4-fluorophenyl)-1-butanone IUPAC Name: 4-[4-(4-amino-5-nitropyridin-2-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one Traditional Name: 4-[4-(4-amino-5-nitro-2-pyridyl)piperazino]-1-(4-fluorophenyl)butan-1-one Formula: C19H22FN5O3 MolecularWeight: 387.408083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=NC=C(C(=C3)N)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=NC=C(C(=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C19H22FN5O3/c20-15-5-3-14(4-6-15)18(26)2-1-7-23-8-10-24(11-9-23)19-12-16(21)17(13-22-19)25(27)28/h3-6,12-13H,1-2,7-11H2,(H2,21,22)