[5-azaniumyl-3,4-bis(oxidanyl)-1,6-diphenyl-hexan-2-yl]azanium

Systemtic Name: [5-azaniumyl-3,4-bis(oxidanyl)-1,6-diphenyl-hexan-2-yl]azanium Openeye Name: (4-azaniumyl-1-benzyl-2,3-dihydroxy-5-phenyl-pentyl)ammonium CAS Name: (5-ammonio-3,4-dihydroxy-1,6-diphenylhexan-2-yl)ammonium IUPAC Name: (5-azaniumyl-3,4-dihydroxy-1,6-diphenylhexan-2-yl)azanium Traditional Name: (4-ammonio-1-benzyl-2,3-dihydroxy-5-phenyl-pentyl)ammonium Formula: C18H26N2O2+2 MolecularWeight: 302.41124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(C(C(CC2=CC=CC=C2)[NH3+])O)O)[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)CC(C(C(C(CC2=CC=CC=C2)[NH3+])O)O)[NH3+]

InChI

InChI=1S/C18H24N2O2/c19-15(11-13-7-3-1-4-8-13)17(21)18(22)16(20)12-14-9-5-2-6-10-14/h1-10,15-18,21-22H,11-12,19-20H2/p+2