[(2R)-3-[4-(4-cyanophenyl)phenoxy]-2-oxidanyl-propyl]-bis(phenylmethyl)azanium

Systemtic Name: [(2R)-3-[4-(4-cyanophenyl)phenoxy]-2-oxidanyl-propyl]-bis(phenylmethyl)azanium Openeye Name: dibenzyl-[(2R)-3-[4-(4-cyanophenyl)phenoxy]-2-hydroxy-propyl]ammonium CAS Name: [(2R)-3-[4-(4-cyanophenyl)phenoxy]-2-hydroxypropyl]-bis(phenylmethyl)ammonium IUPAC Name: dibenzyl-[(2R)-3-[4-(4-cyanophenyl)phenoxy]-2-hydroxypropyl]azanium Traditional Name: dibenzyl-[(2R)-3-[4-(4-cyanophenyl)phenoxy]-2-hydroxy-propyl]ammonium Formula: C30H29N2O2+ MolecularWeight: 449.56346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH+](CC2=CC=CC=C2)CC(COC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)O

Isomeric SMILES

C1=CC=C(C=C1)C[NH+](CC2=CC=CC=C2)C[C@H](COC3=CC=C(C=C3)C4=CC=C(C=C4)C#N)O

InChI

InChI=1S/C30H28N2O2/c31-19-24-11-13-27(14-12-24)28-15-17-30(18-16-28)34-23-29(33)22-32(20-25-7-3-1-4-8-25)21-26-9-5-2-6-10-26/h1-18,29,33H,20-23H2/p+1/t29-/m1/s1