3-[3-(dimethylazaniumyl)propyl-[(E)-2-methyl-3-phenyl-prop-2-enyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[3-(dimethylazaniumyl)propyl-[(E)-2-methyl-3-phenyl-prop-2-enyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[3-(dimethylammonio)propyl-[(E)-2-methyl-3-phenyl-allyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[3-(dimethylammonio)propyl-[(E)-2-methyl-3-phenylprop-2-enyl]amino]propyl-dimethylammonium IUPAC Name: 3-[3-(dimethylazaniumyl)propyl-[(E)-2-methyl-3-phenylprop-2-enyl]amino]propyl-dimethylazanium Traditional Name: 3-[3-(dimethylammonio)propyl-[(E)-2-methyl-3-phenyl-allyl]amino]propyl-dimethyl-ammonium Formula: C20H37N3+2 MolecularWeight: 319.52788

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)CN(CCC[NH+](C)C)CCC[NH+](C)C

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/CN(CCC[NH+](C)C)CCC[NH+](C)C

InChI

InChI=1S/C20H35N3/c1-19(17-20-11-7-6-8-12-20)18-23(15-9-13-21(2)3)16-10-14-22(4)5/h6-8,11-12,17H,9-10,13-16,18H2,1-5H3/p+2/b19-17+