2-azaniumyl-3-phenyl-2-(phenylmethyl)propanoate

Systemtic Name: 2-azaniumyl-3-phenyl-2-(phenylmethyl)propanoate Openeye Name: 2-azaniumyl-2-benzyl-3-phenyl-propanoate CAS Name: 2-ammonio-3-phenyl-2-(phenylmethyl)propanoate IUPAC Name: 2-azaniumyl-2-benzyl-3-phenylpropanoate Traditional Name: 2-ammonio-2-benzyl-3-phenyl-propionate Formula: C16H17NO2 MolecularWeight: 255.31168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC2=CC=CC=C2)(C(=O)[O-])[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)CC(CC2=CC=CC=C2)(C(=O)[O-])[NH3+]

InChI

InChI=1S/C16H17NO2/c17-16(15(18)19,11-13-7-3-1-4-8-13)12-14-9-5-2-6-10-14/h1-10H,11-12,17H2,(H,18,19)