(E)-2-cyano-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(4-piperidin-1-ylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(4-piperidin-1-ylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)-3-[4-(1-piperidyl)phenyl]prop-2-enamide CAS Name: (E)-2-cyano-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)-3-[4-(1-piperidinyl)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(4-piperidin-1-ylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(4-piperidinophenyl)acrylamide Formula: C23H22N4O5 MolecularWeight: 434.44458

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)C=C(C#N)C(=O)NC3=CC4=C(C=C3[N+](=O)[O-])OCCO4

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)/C=C(\C#N)/C(=O)NC3=CC4=C(C=C3[N+](=O)[O-])OCCO4

InChI

InChI=1S/C23H22N4O5/c24-15-17(12-16-4-6-18(7-5-16)26-8-2-1-3-9-26)23(28)25-19-13-21-22(32-11-10-31-21)14-20(19)27(29)30/h4-7,12-14H,1-3,8-11H2,(H,25,28)/b17-12+