(E)-3-(4-chlorophenyl)-1-[4-(3-nitropyridin-2-yl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-chlorophenyl)-1-[4-(3-nitropyridin-2-yl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-chlorophenyl)-1-[4-(3-nitro-2-pyridyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-chlorophenyl)-1-[4-(3-nitro-2-pyridinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-chlorophenyl)-1-[4-(3-nitropyridin-2-yl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-chlorophenyl)-1-[4-(3-nitro-2-pyridyl)piperazino]prop-2-en-1-one Formula: C18H17ClN4O3 MolecularWeight: 372.80558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=N2)[N+](=O)[O-])C(=O)C=CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=N2)[N+](=O)[O-])C(=O)/C=C/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClN4O3/c19-15-6-3-14(4-7-15)5-8-17(24)21-10-12-22(13-11-21)18-16(23(25)26)2-1-9-20-18/h1-9H,10-13H2/b8-5+