N-[(2R)-3-methyl-1-oxidanylidene-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]butan-2-yl]-2-phenyl-ethanamide

Systemtic Name: N-[(2R)-3-methyl-1-oxidanylidene-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]butan-2-yl]-2-phenyl-ethanamide Openeye Name: N-[(1R)-1-[4-[(E)-cinnamyl]piperazin-4-ium-1-carbonyl]-2-methyl-propyl]-2-phenyl-acetamide CAS Name: N-[(2R)-3-methyl-1-oxo-1-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]butan-2-yl]-2-phenylacetamide IUPAC Name: N-[(2R)-3-methyl-1-oxo-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]butan-2-yl]-2-phenylacetamide Traditional Name: N-[(1R)-1-[4-[(E)-cinnamyl]piperazin-4-ium-1-carbonyl]-2-methyl-propyl]-2-phenyl-acetamide Formula: C26H34N3O2+ MolecularWeight: 420.56706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CC[NH+](CC1)CC=CC2=CC=CC=C2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@H](C(=O)N1CC[NH+](CC1)C/C=C/C2=CC=CC=C2)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C26H33N3O2/c1-21(2)25(27-24(30)20-23-12-7-4-8-13-23)26(31)29-18-16-28(17-19-29)15-9-14-22-10-5-3-6-11-22/h3-14,21,25H,15-20H2,1-2H3,(H,27,30)/p+1/b14-9+/t25-/m1/s1