N-(cyclopropylmethyl)-2-[[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methyl]-1,3-oxazole-4-carboxamide

Systemtic Name: N-(cyclopropylmethyl)-2-[[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-[[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]methyl]-N-(cyclopropylmethyl)oxazole-4-carboxamide CAS Name: N-(cyclopropylmethyl)-2-[[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]methyl]-4-oxazolecarboxamide IUPAC Name: N-(cyclopropylmethyl)-2-[[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methyl]-1,3-oxazole-4-carboxamide Traditional Name: 2-[[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]methyl]-N-(cyclopropylmethyl)oxazole-4-carboxamide Formula: C22H29N4O2+ MolecularWeight: 381.49126

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC(=O)C2=COC(=N2)CN3CC[NH+](CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

C1CC1CNC(=O)C2=COC(=N2)CN3CC[NH+](CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C22H28N4O2/c27-22(23-15-19-8-9-19)20-17-28-21(24-20)16-26-13-11-25(12-14-26)10-4-7-18-5-2-1-3-6-18/h1-7,17,19H,8-16H2,(H,23,27)/p+1/b7-4+