[(2R)-3-(2-methoxy-4-prop-2-enyl-phenoxy)-2-oxidanyl-propyl]-(2,4,4-trimethylpentan-2-yl)azanium

Systemtic Name: [(2R)-3-(2-methoxy-4-prop-2-enyl-phenoxy)-2-oxidanyl-propyl]-(2,4,4-trimethylpentan-2-yl)azanium Openeye Name: [(2R)-3-(4-allyl-2-methoxy-phenoxy)-2-hydroxy-propyl]-(1,1,3,3-tetramethylbutyl)ammonium CAS Name: [(2R)-2-hydroxy-3-(2-methoxy-4-prop-2-enylphenoxy)propyl]-(2,4,4-trimethylpentan-2-yl)ammonium IUPAC Name: [(2R)-2-hydroxy-3-(2-methoxy-4-prop-2-enylphenoxy)propyl]-(2,4,4-trimethylpentan-2-yl)azanium Traditional Name: [(2R)-3-(4-allyl-2-methoxy-phenoxy)-2-hydroxy-propyl]-(1,1,3,3-tetramethylbutyl)ammonium Formula: C21H36NO3+ MolecularWeight: 350.51544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)[NH2+]CC(COC1=C(C=C(C=C1)CC=C)OC)O

Isomeric SMILES

CC(C)(C)CC(C)(C)[NH2+]C[C@H](COC1=C(C=C(C=C1)CC=C)OC)O

InChI

InChI=1S/C21H35NO3/c1-8-9-16-10-11-18(19(12-16)24-7)25-14-17(23)13-22-21(5,6)15-20(2,3)4/h8,10-12,17,22-23H,1,9,13-15H2,2-7H3/p+1/t17-/m1/s1