[(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(3-methoxy-4-oxidanyl-5-prop-2-enyl-phenyl)ethyl]azanium

Systemtic Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(3-methoxy-4-oxidanyl-5-prop-2-enyl-phenyl)ethyl]azanium Openeye Name: [(2R)-2-(3-allyl-4-hydroxy-5-methoxy-phenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]ammonium CAS Name: [(2R)-2-[(2S)-2-ethyl-1-piperidin-1-iumyl]-2-(4-hydroxy-3-methoxy-5-prop-2-enylphenyl)ethyl]ammonium IUPAC Name: [(2R)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-2-(4-hydroxy-3-methoxy-5-prop-2-enylphenyl)ethyl]azanium Traditional Name: [(2R)-2-(3-allyl-4-hydroxy-5-methoxy-phenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethyl]ammonium Formula: C19H32N2O2+2 MolecularWeight: 320.46958

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1C(C[NH3+])C2=CC(=C(C(=C2)OC)O)CC=C

Isomeric SMILES

CC[C@H]1CCCC[NH+]1[C@@H](C[NH3+])C2=CC(=C(C(=C2)OC)O)CC=C

InChI

InChI=1S/C19H30N2O2/c1-4-8-14-11-15(12-18(23-3)19(14)22)17(13-20)21-10-7-6-9-16(21)5-2/h4,11-12,16-17,22H,1,5-10,13,20H2,2-3H3/p+2/t16-,17-/m0/s1