[(2S)-2-oxidanyl-3-(2-prop-2-enylphenoxy)propyl]-bis(phenylmethyl)azanium

Systemtic Name: [(2S)-2-oxidanyl-3-(2-prop-2-enylphenoxy)propyl]-bis(phenylmethyl)azanium Openeye Name: [(2S)-3-(2-allylphenoxy)-2-hydroxy-propyl]-dibenzyl-ammonium CAS Name: [(2S)-2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]-bis(phenylmethyl)ammonium IUPAC Name: dibenzyl-[(2S)-2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]azanium Traditional Name: [(2S)-3-(2-allylphenoxy)-2-hydroxy-propyl]-dibenzyl-ammonium Formula: C26H30NO2+ MolecularWeight: 388.5219

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC=C1OCC(C[NH+](CC2=CC=CC=C2)CC3=CC=CC=C3)O

Isomeric SMILES

C=CCC1=CC=CC=C1OC[C@H](C[NH+](CC2=CC=CC=C2)CC3=CC=CC=C3)O

InChI

InChI=1S/C26H29NO2/c1-2-11-24-16-9-10-17-26(24)29-21-25(28)20-27(18-22-12-5-3-6-13-22)19-23-14-7-4-8-15-23/h2-10,12-17,25,28H,1,11,18-21H2/p+1/t25-/m0/s1