[4-[(2R)-3-ethoxy-2-methyl-3-oxidanylidene-propyl]phenyl]methylazanium

Systemtic Name: [4-[(2R)-3-ethoxy-2-methyl-3-oxidanylidene-propyl]phenyl]methylazanium Openeye Name: [4-[(2R)-3-ethoxy-2-methyl-3-oxo-propyl]phenyl]methylammonium CAS Name: [4-[(2R)-3-ethoxy-2-methyl-3-oxopropyl]phenyl]methylammonium IUPAC Name: [4-[(2R)-3-ethoxy-2-methyl-3-oxopropyl]phenyl]methylazanium Traditional Name: [4-[(2R)-3-ethoxy-3-keto-2-methyl-propyl]benzyl]ammonium Formula: C13H20NO2+ MolecularWeight: 222.3034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)CC1=CC=C(C=C1)C[NH3+]

Isomeric SMILES

CCOC(=O)[C@H](C)CC1=CC=C(C=C1)C[NH3+]

InChI

InChI=1S/C13H19NO2/c1-3-16-13(15)10(2)8-11-4-6-12(9-14)7-5-11/h4-7,10H,3,8-9,14H2,1-2H3/p+1/t10-/m1/s1