diethyl-[(E)-5-oxidanyl-4-(oxidanylamino)-5,5-diphenyl-pent-3-enyl]-(phenylmethyl)azanium

Systemtic Name: diethyl-[(E)-5-oxidanyl-4-(oxidanylamino)-5,5-diphenyl-pent-3-enyl]-(phenylmethyl)azanium Openeye Name: benzyl-diethyl-[(E)-5-hydroxy-4-(hydroxyamino)-5,5-diphenyl-pent-3-enyl]ammonium CAS Name: diethyl-[(E)-5-hydroxy-4-(hydroxyamino)-5,5-diphenylpent-3-enyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-diethyl-[(E)-5-hydroxy-4-(hydroxyamino)-5,5-diphenylpent-3-enyl]azanium Traditional Name: benzyl-diethyl-[(E)-5-hydroxy-4-(hydroxyamino)-5,5-diphenyl-pent-3-enyl]ammonium Formula: C28H35N2O2+ MolecularWeight: 431.5897

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CCC=C(C(C1=CC=CC=C1)(C2=CC=CC=C2)O)NO)CC3=CC=CC=C3

Isomeric SMILES

CC[N+](CC)(CC/C=C(\C(C1=CC=CC=C1)(C2=CC=CC=C2)O)/NO)CC3=CC=CC=C3

InChI

InChI=1S/C28H35N2O2/c1-3-30(4-2,23-24-15-8-5-9-16-24)22-14-21-27(29-32)28(31,25-17-10-6-11-18-25)26-19-12-7-13-20-26/h5-13,15-21,29,31-32H,3-4,14,22-23H2,1-2H3/q+1/b27-21+