2-oxidanylpropane-1,2,3-tricarboxylate; N-phenylpropanamide

Systemtic Name: 2-oxidanylpropane-1,2,3-tricarboxylate; N-phenylpropanamide Openeye Name: N-phenylpropanamide citrate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylate; N-phenylpropanamide IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate; N-phenylpropanamide Traditional Name: N-phenylpropionamide citrate Formula: C15H16NO8-3 MolecularWeight: 338.28944

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=CC=C1.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

CCC(=O)NC1=CC=CC=C1.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C9H11NO.C6H8O7/c1-2-9(11)10-8-6-4-3-5-7-8;7-3(8)1-6(13,5(11)12)2-4(9)10/h3-7H,2H2,1H3,(H,10,11);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3