(3S)-3-azaniumyl-3-(4-phenethyloxyphenyl)propanoate

Systemtic Name: (3S)-3-azaniumyl-3-(4-phenethyloxyphenyl)propanoate Openeye Name: (3S)-3-azaniumyl-3-(4-phenethyloxyphenyl)propanoate CAS Name: (3S)-3-ammonio-3-(4-phenethyloxyphenyl)propanoate IUPAC Name: (3S)-3-azaniumyl-3-(4-phenethyloxyphenyl)propanoate Traditional Name: (3S)-3-ammonio-3-(4-phenethyloxyphenyl)propionate Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=CC=C(C=C2)C(CC(=O)[O-])[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=CC=C(C=C2)[C@H](CC(=O)[O-])[NH3+]

InChI

InChI=1S/C17H19NO3/c18-16(12-17(19)20)14-6-8-15(9-7-14)21-11-10-13-4-2-1-3-5-13/h1-9,16H,10-12,18H2,(H,19,20)/t16-/m0/s1