(2R)-2-azaniumyl-2-(3-methoxy-4-phenylmethoxy-phenyl)ethanoate

Systemtic Name: (2R)-2-azaniumyl-2-(3-methoxy-4-phenylmethoxy-phenyl)ethanoate Openeye Name: (2R)-2-azaniumyl-2-(4-benzyloxy-3-methoxy-phenyl)acetate CAS Name: (2R)-2-ammonio-2-(3-methoxy-4-phenylmethoxyphenyl)acetate IUPAC Name: (2R)-2-azaniumyl-2-(3-methoxy-4-phenylmethoxyphenyl)acetate Traditional Name: (2R)-2-ammonio-2-(4-benzoxy-3-methoxy-phenyl)acetate Formula: C16H17NO4 MolecularWeight: 287.31048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C(=O)[O-])[NH3+])OCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=CC(=C1)[C@H](C(=O)[O-])[NH3+])OCC2=CC=CC=C2

InChI

InChI=1S/C16H17NO4/c1-20-14-9-12(15(17)16(18)19)7-8-13(14)21-10-11-5-3-2-4-6-11/h2-9,15H,10,17H2,1H3,(H,18,19)/t15-/m1/s1