sodium 3-phenylmethoxy-2-(3-phenylpropanoylamino)propanoate

Systemtic Name: sodium 3-phenylmethoxy-2-(3-phenylpropanoylamino)propanoate Openeye Name: sodium 3-benzyloxy-2-(3-phenylpropanoylamino)propanoate CAS Name: sodium 2-[(1-oxo-3-phenylpropyl)amino]-3-phenylmethoxypropanoate IUPAC Name: sodium 3-phenylmethoxy-2-(3-phenylpropanoylamino)propanoate Traditional Name: sodium 3-benzoxy-2-(hydrocinnamoylamino)propionate Formula: C19H20NNaO4 MolecularWeight: 349.35617

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC(COCC2=CC=CC=C2)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC(COCC2=CC=CC=C2)C(=O)[O-].[Na+]

InChI

InChI=1S/C19H21NO4.Na/c21-18(12-11-15-7-3-1-4-8-15)20-17(19(22)23)14-24-13-16-9-5-2-6-10-16;/h1-10,17H,11-14H2,(H,20,21)(H,22,23);/q;+1/p-1