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

Systemtic Name: [(2R)-2-(3-methoxy-4-oxidanyl-5-prop-2-enyl-phenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]azanium Openeye Name: [(2R)-2-(3-allyl-4-hydroxy-5-methoxy-phenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]ammonium CAS Name: [(2R)-2-(4-hydroxy-3-methoxy-5-prop-2-enylphenyl)-2-(4-methyl-1-piperidin-1-iumyl)ethyl]ammonium IUPAC Name: [(2R)-2-(4-hydroxy-3-methoxy-5-prop-2-enylphenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]azanium Traditional Name: [(2R)-2-(3-allyl-4-hydroxy-5-methoxy-phenyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]ammonium Formula: C18H30N2O2+2 MolecularWeight: 306.443

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(C[NH3+])C2=CC(=C(C(=C2)OC)O)CC=C

Isomeric SMILES

CC1CC[NH+](CC1)[C@@H](C[NH3+])C2=CC(=C(C(=C2)OC)O)CC=C

InChI

InChI=1S/C18H28N2O2/c1-4-5-14-10-15(11-17(22-3)18(14)21)16(12-19)20-8-6-13(2)7-9-20/h4,10-11,13,16,21H,1,5-9,12,19H2,2-3H3/p+2/t16-/m0/s1