(E)-3-(1-methylpyrazol-4-yl)-1-[4-(2-nitrophenyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(1-methylpyrazol-4-yl)-1-[4-(2-nitrophenyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(1-methylpyrazol-4-yl)-1-[4-(2-nitrophenyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(1-methyl-4-pyrazolyl)-1-[4-(2-nitrophenyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(1-methylpyrazol-4-yl)-1-[4-(2-nitrophenyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(1-methylpyrazol-4-yl)-1-[4-(2-nitrophenyl)piperazino]prop-2-en-1-one Formula: C17H19N5O3 MolecularWeight: 341.36446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C=CC(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=N1)/C=C/C(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H19N5O3/c1-19-13-14(12-18-19)6-7-17(23)21-10-8-20(9-11-21)15-4-2-3-5-16(15)22(24)25/h2-7,12-13H,8-11H2,1H3/b7-6+