[(2S)-2-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-2-oxidanyl-ethyl]azanium

Systemtic Name: [(2S)-2-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-2-oxidanyl-ethyl]azanium Openeye Name: [(2S)-2-hydroxy-2-[3-methoxy-4-(p-tolylmethoxy)phenyl]ethyl]ammonium CAS Name: [(2S)-2-hydroxy-2-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]ethyl]ammonium IUPAC Name: [(2S)-2-hydroxy-2-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]ethyl]azanium Traditional Name: [(2S)-2-hydroxy-2-[3-methoxy-4-(4-methylbenzyl)oxy-phenyl]ethyl]ammonium Formula: C17H22NO3+ MolecularWeight: 288.36148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2)C(C[NH3+])O)OC

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2)[C@@H](C[NH3+])O)OC

InChI

InChI=1S/C17H21NO3/c1-12-3-5-13(6-4-12)11-21-16-8-7-14(15(19)10-18)9-17(16)20-2/h3-9,15,19H,10-11,18H2,1-2H3/p+1/t15-/m1/s1