[(2R)-3-(diphenylmethyl)oxy-2-oxidanyl-propyl]-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [(2R)-3-(diphenylmethyl)oxy-2-oxidanyl-propyl]-(3-imidazol-1-ylpropyl)azanium Openeye Name: [(2R)-3-benzhydryloxy-2-hydroxy-propyl]-(3-imidazol-1-ylpropyl)ammonium CAS Name: [(2R)-3-(diphenylmethyl)oxy-2-hydroxypropyl]-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: [(2R)-3-benzhydryloxy-2-hydroxypropyl]-(3-imidazol-1-ylpropyl)azanium Traditional Name: [(2R)-3-benzhydryloxy-2-hydroxy-propyl]-(3-imidazol-1-ylpropyl)ammonium Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)OCC(C[NH2+]CCCN3C=CN=C3)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC[C@@H](C[NH2+]CCCN3C=CN=C3)O

InChI

InChI=1S/C22H27N3O2/c26-21(16-23-12-7-14-25-15-13-24-18-25)17-27-22(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-6,8-11,13,15,18,21-23,26H,7,12,14,16-17H2/p+1/t21-/m1/s1