(2R)-2-azaniumyl-2-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]ethanoate

Systemtic Name: (2R)-2-azaniumyl-2-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]ethanoate Openeye Name: (2R)-2-azaniumyl-2-[3-methoxy-4-(p-tolylmethoxy)phenyl]acetate CAS Name: (2R)-2-ammonio-2-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]acetate IUPAC Name: (2R)-2-azaniumyl-2-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]acetate Traditional Name: (2R)-2-ammonio-2-[3-methoxy-4-(4-methylbenzyl)oxy-phenyl]acetate Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO4/c1-11-3-5-12(6-4-11)10-22-14-8-7-13(9-15(14)21-2)16(18)17(19)20/h3-9,16H,10,18H2,1-2H3,(H,19,20)/t16-/m1/s1