N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carboxamide Openeye Name: N-butyl-4-[(E)-cinnamyl]piperazin-4-ium-1-carboxamide CAS Name: N-butyl-4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-butyl-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carboxamide Traditional Name: N-butyl-4-[(E)-cinnamyl]piperazin-4-ium-1-carboxamide Formula: C18H28N3O+ MolecularWeight: 302.43442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CC[NH+](CC1)CC=CC2=CC=CC=C2

Isomeric SMILES

CCCCNC(=O)N1CC[NH+](CC1)C/C=C/C2=CC=CC=C2

InChI

InChI=1S/C18H27N3O/c1-2-3-11-19-18(22)21-15-13-20(14-16-21)12-7-10-17-8-5-4-6-9-17/h4-10H,2-3,11-16H2,1H3,(H,19,22)/p+1/b10-7+