[2,4-bis(oxidanyl)phenyl]methyl-[(2R)-4-phenylbutan-2-yl]azanium

Systemtic Name: [2,4-bis(oxidanyl)phenyl]methyl-[(2R)-4-phenylbutan-2-yl]azanium Openeye Name: (2,4-dihydroxyphenyl)methyl-[(1R)-1-methyl-3-phenyl-propyl]ammonium CAS Name: (2,4-dihydroxyphenyl)methyl-[(2R)-4-phenylbutan-2-yl]ammonium IUPAC Name: (2,4-dihydroxyphenyl)methyl-[(2R)-4-phenylbutan-2-yl]azanium Traditional Name: (2,4-dihydroxybenzyl)-[(1R)-1-methyl-3-phenyl-propyl]ammonium Formula: C17H22NO2+ MolecularWeight: 272.36208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)[NH2+]CC2=C(C=C(C=C2)O)O

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)[NH2+]CC2=C(C=C(C=C2)O)O

InChI

InChI=1S/C17H21NO2/c1-13(7-8-14-5-3-2-4-6-14)18-12-15-9-10-16(19)11-17(15)20/h2-6,9-11,13,18-20H,7-8,12H2,1H3/p+1/t13-/m1/s1