(2R)-N-(methylcarbamoyl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(methylcarbamoyl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-2-[4-[(E)-cinnamyl]piperazin-1-ium-1-yl]-N-(methylcarbamoyl)propanamide CAS Name: (2R)-N-(methylcarbamoyl)-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-(methylcarbamoyl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-2-[4-[(E)-cinnamyl]piperazin-1-ium-1-yl]-N-(methylcarbamoyl)propionamide Formula: C18H27N4O2+ MolecularWeight: 331.43258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)[NH+]1CCN(CC1)CC=CC2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC)[NH+]1CCN(CC1)C/C=C/C2=CC=CC=C2

InChI

InChI=1S/C18H26N4O2/c1-15(17(23)20-18(24)19-2)22-13-11-21(12-14-22)10-6-9-16-7-4-3-5-8-16/h3-9,15H,10-14H2,1-2H3,(H2,19,20,23,24)/p+1/b9-6+/t15-/m1/s1