3-phenyl-3-[(phenylmethyl)azaniumyl]propanoate

Systemtic Name: 3-phenyl-3-[(phenylmethyl)azaniumyl]propanoate Openeye Name: 3-(benzylammonio)-3-phenyl-propanoate CAS Name: 3-phenyl-3-[(phenylmethyl)ammonio]propanoate IUPAC Name: 3-(benzylazaniumyl)-3-phenylpropanoate Traditional Name: 3-(benzylammonio)-3-phenyl-propionate Formula: C16H17NO2 MolecularWeight: 255.31168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH2+]C(CC(=O)[O-])C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C[NH2+]C(CC(=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C16H17NO2/c18-16(19)11-15(14-9-5-2-6-10-14)17-12-13-7-3-1-4-8-13/h1-10,15,17H,11-12H2,(H,18,19)