(E)-3-(4-nitrophenyl)-1-[4-(6-propoxypyridazin-3-yl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-nitrophenyl)-1-[4-(6-propoxypyridazin-3-yl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-nitrophenyl)-1-[4-(6-propoxypyridazin-3-yl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-nitrophenyl)-1-[4-(6-propoxy-3-pyridazinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-nitrophenyl)-1-[4-(6-propoxypyridazin-3-yl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-nitrophenyl)-1-[4-(6-propoxypyridazin-3-yl)piperazino]prop-2-en-1-one Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN=C(C=C1)N2CCN(CC2)C(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=NN=C(C=C1)N2CCN(CC2)C(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O4/c1-2-15-29-19-9-8-18(21-22-19)23-11-13-24(14-12-23)20(26)10-5-16-3-6-17(7-4-16)25(27)28/h3-10H,2,11-15H2,1H3/b10-5+