[(Z,2R)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-5-phenyl-pent-4-enyl]azanium

Systemtic Name: [(Z,2R)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-5-phenyl-pent-4-enyl]azanium Openeye Name: [(Z,2R)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-5-phenyl-pent-4-enyl]ammonium CAS Name: [(Z,2R)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]-5-phenylpent-4-enyl]ammonium IUPAC Name: [(Z,2R)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-5-phenylpent-4-enyl]azanium Traditional Name: [(Z,2R)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-5-phenyl-pent-4-enyl]ammonium Formula: C17H28N2+2 MolecularWeight: 260.41762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(CC=CC2=CC=CC=C2)C[NH3+]

Isomeric SMILES

C[C@H]1CCC[NH+](C1)[C@H](C/C=C\C2=CC=CC=C2)C[NH3+]

InChI

InChI=1S/C17H26N2/c1-15-7-6-12-19(14-15)17(13-18)11-5-10-16-8-3-2-4-9-16/h2-5,8-10,15,17H,6-7,11-14,18H2,1H3/p+2/b10-5-/t15-,17+/m0/s1