(E)-3-[5-(2-methoxy-5-nitro-phenyl)furan-2-yl]-2-(4-phenylpiperazin-1-yl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[5-(2-methoxy-5-nitro-phenyl)furan-2-yl]-2-(4-phenylpiperazin-1-yl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-[5-(2-methoxy-5-nitro-phenyl)-2-furyl]-2-(4-phenylpiperazine-1-carbonyl)prop-2-enenitrile CAS Name: (E)-3-[5-(2-methoxy-5-nitrophenyl)-2-furanyl]-2-[oxo-(4-phenyl-1-piperazinyl)methyl]-2-propenenitrile IUPAC Name: (E)-3-[5-(2-methoxy-5-nitrophenyl)furan-2-yl]-2-(4-phenylpiperazine-1-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-[5-(2-methoxy-5-nitro-phenyl)-2-furyl]-2-(4-phenylpiperazine-1-carbonyl)acrylonitrile Formula: C25H22N4O5 MolecularWeight: 458.46598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C2=CC=C(O2)C=C(C#N)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C2=CC=C(O2)/C=C(\C#N)/C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H22N4O5/c1-33-23-9-7-20(29(31)32)16-22(23)24-10-8-21(34-24)15-18(17-26)25(30)28-13-11-27(12-14-28)19-5-3-2-4-6-19/h2-10,15-16H,11-14H2,1H3/b18-15+