4-[4-(6-azanyl-5-nitro-pyridin-2-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one; ethene

Systemtic Name: 4-[4-(6-azanyl-5-nitro-pyridin-2-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one; ethene Openeye Name: 4-[4-(6-amino-5-nitro-2-pyridyl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one; ethylene CAS Name: 4-[4-(6-amino-5-nitro-2-pyridinyl)-1-piperazinyl]-1-(4-fluorophenyl)-1-butanone; ethene IUPAC Name: 4-[4-(6-amino-5-nitropyridin-2-yl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one; ethene Traditional Name: 4-[4-(6-amino-5-nitro-2-pyridyl)piperazino]-1-(4-fluorophenyl)butan-1-one; ethylene Formula: C21H26FN5O3 MolecularWeight: 415.461243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22FN5O3.C2H4/c20-15-5-3-14(4-6-15)17(26)2-1-9-23-10-12-24(13-11-23)18-8-7-16(25(27)28)19(21)22-18;1-2/h3-8H,1-2,9-13H2,(H2,21,22);1-2H2