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

Systemtic Name: N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-4-propoxy-benzamide Openeye Name: N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-4-propoxy-benzamide CAS Name: N-[4-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]phenyl]-4-propoxybenzamide IUPAC Name: N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]-4-propoxybenzamide Traditional Name: N-[4-[4-[(E)-3-phenylacryloyl]piperazino]phenyl]-4-propoxy-benzamide Formula: C29H31N3O3 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C29H31N3O3/c1-2-22-35-27-15-9-24(10-16-27)29(34)30-25-11-13-26(14-12-25)31-18-20-32(21-19-31)28(33)17-8-23-6-4-3-5-7-23/h3-17H,2,18-22H2,1H3,(H,30,34)/b17-8+