N-[3-oxidanylidene-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]propyl]furan-2-carboxamide

Systemtic Name: N-[3-oxidanylidene-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]propyl]furan-2-carboxamide Openeye Name: N-[3-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-3-oxo-propyl]furan-2-carboxamide CAS Name: N-[3-oxo-3-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]propyl]-2-furancarboxamide IUPAC Name: N-[3-oxo-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]propyl]furan-2-carboxamide Traditional Name: N-[3-[4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-3-keto-propyl]-2-furamide Formula: C21H26N3O3+ MolecularWeight: 368.44944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC=CC2=CC=CC=C2)C(=O)CCNC(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CC[NH+]1C/C=C/C2=CC=CC=C2)C(=O)CCNC(=O)C3=CC=CO3

InChI

InChI=1S/C21H25N3O3/c25-20(10-11-22-21(26)19-9-5-17-27-19)24-15-13-23(14-16-24)12-4-8-18-6-2-1-3-7-18/h1-9,17H,10-16H2,(H,22,26)/p+1/b8-4+