3-nitro-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-4-piperidin-1-yl-benzamide

Systemtic Name: 3-nitro-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-4-piperidin-1-yl-benzamide Openeye Name: 3-nitro-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-4-(1-piperidyl)benzamide CAS Name: 3-nitro-N-[4-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]phenyl]-4-(1-piperidinyl)benzamide IUPAC Name: 3-nitro-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-4-piperidin-1-ylbenzamide Traditional Name: 3-nitro-N-[4-[4-[(E)-3-phenylacryloyl]piperazino]phenyl]-4-piperidino-benzamide Formula: C31H33N5O4 MolecularWeight: 539.62482

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C=CC5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)/C=C/C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C31H33N5O4/c37-30(16-9-24-7-3-1-4-8-24)35-21-19-33(20-22-35)27-13-11-26(12-14-27)32-31(38)25-10-15-28(29(23-25)36(39)40)34-17-5-2-6-18-34/h1,3-4,7-16,23H,2,5-6,17-22H2,(H,32,38)/b16-9+