1-[(3R)-3-(5-methylfuran-2-yl)butyl]-4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium

Systemtic Name: 1-[(3R)-3-(5-methylfuran-2-yl)butyl]-4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium Openeye Name: 1-[(E)-cinnamyl]-4-[(3R)-3-(5-methyl-2-furyl)butyl]piperazin-4-ium CAS Name: 1-[(3R)-3-(5-methyl-2-furanyl)butyl]-4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium IUPAC Name: 1-[(3R)-3-(5-methylfuran-2-yl)butyl]-4-[(E)-3-phenylprop-2-enyl]piperazin-1-ium Traditional Name: 1-[(E)-cinnamyl]-4-[(3R)-3-(5-methyl-2-furyl)butyl]piperazin-4-ium Formula: C22H31N2O+ MolecularWeight: 339.49434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(C)CC[NH+]2CCN(CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(O1)[C@H](C)CC[NH+]2CCN(CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H30N2O/c1-19(22-11-10-20(2)25-22)12-14-24-17-15-23(16-18-24)13-6-9-21-7-4-3-5-8-21/h3-11,19H,12-18H2,1-2H3/p+1/b9-6+/t19-/m1/s1