[(3R)-3-(furan-2-yl)-6-methyl-heptyl]-[(E)-3-phenylprop-2-enyl]azanium

Systemtic Name: [(3R)-3-(furan-2-yl)-6-methyl-heptyl]-[(E)-3-phenylprop-2-enyl]azanium Openeye Name: [(E)-cinnamyl]-[(3R)-3-(2-furyl)-6-methyl-heptyl]ammonium CAS Name: [(3R)-3-(2-furanyl)-6-methylheptyl]-[(E)-3-phenylprop-2-enyl]ammonium IUPAC Name: [(3R)-3-(furan-2-yl)-6-methylheptyl]-[(E)-3-phenylprop-2-enyl]azanium Traditional Name: [(E)-cinnamyl]-[(3R)-3-(2-furyl)-6-methyl-heptyl]ammonium Formula: C21H30NO+ MolecularWeight: 312.469

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(CC[NH2+]CC=CC1=CC=CC=C1)C2=CC=CO2

Isomeric SMILES

CC(C)CC[C@H](CC[NH2+]C/C=C/C1=CC=CC=C1)C2=CC=CO2

InChI

InChI=1S/C21H29NO/c1-18(2)12-13-20(21-11-7-17-23-21)14-16-22-15-6-10-19-8-4-3-5-9-19/h3-11,17-18,20,22H,12-16H2,1-2H3/p+1/b10-6+/t20-/m1/s1