[(Z)-2-chloranyl-3-phenyl-prop-2-enyl]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [(Z)-2-chloranyl-3-phenyl-prop-2-enyl]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [(Z)-2-chloro-3-phenyl-allyl]-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [(Z)-2-chloro-3-phenylprop-2-enyl]-methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [(Z)-2-chloro-3-phenylprop-2-enyl]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [(Z)-2-chloro-3-phenyl-allyl]-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C16H25ClN2+2 MolecularWeight: 280.8361

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+](C)CC(=CC2=CC=CC=C2)Cl

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+](C)C/C(=C/C2=CC=CC=C2)/Cl

InChI

InChI=1S/C16H23ClN2/c1-18-10-8-16(9-11-18)19(2)13-15(17)12-14-6-4-3-5-7-14/h3-7,12,16H,8-11,13H2,1-2H3/p+2/b15-12-