N-(3-methoxypropyl)-5-[[(E)-3-phenylprop-2-enoyl]amino]-2-piperidin-1-yl-benzamide

Systemtic Name: N-(3-methoxypropyl)-5-[[(E)-3-phenylprop-2-enoyl]amino]-2-piperidin-1-yl-benzamide Openeye Name: N-(3-methoxypropyl)-5-[[(E)-3-phenylprop-2-enoyl]amino]-2-(1-piperidyl)benzamide CAS Name: N-(3-methoxypropyl)-5-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-2-(1-piperidinyl)benzamide IUPAC Name: N-(3-methoxypropyl)-5-[[(E)-3-phenylprop-2-enoyl]amino]-2-piperidin-1-ylbenzamide Traditional Name: N-(3-methoxypropyl)-5-[[(E)-3-phenylacryloyl]amino]-2-piperidino-benzamide Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=C(C=CC(=C1)NC(=O)C=CC2=CC=CC=C2)N3CCCCC3

Isomeric SMILES

COCCCNC(=O)C1=C(C=CC(=C1)NC(=O)/C=C/C2=CC=CC=C2)N3CCCCC3

InChI

InChI=1S/C25H31N3O3/c1-31-18-8-15-26-25(30)22-19-21(12-13-23(22)28-16-6-3-7-17-28)27-24(29)14-11-20-9-4-2-5-10-20/h2,4-5,9-14,19H,3,6-8,15-18H2,1H3,(H,26,30)(H,27,29)/b14-11+