2-azanyl-3-(phenylmethyl)benzamide; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: 2-azanyl-3-(phenylmethyl)benzamide; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: 2-amino-3-benzyl-benzamide citrate CAS Name: 2-amino-3-(phenylmethyl)benzamide; 2-hydroxypropane-1,2,3-tricarboxylate IUPAC Name: 2-amino-3-benzylbenzamide; 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: 2-amino-3-benzyl-benzamide citrate Formula: C20H19N2O8-3 MolecularWeight: 415.37346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC(=C2N)C(=O)N.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC(=C2N)C(=O)N.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C14H14N2O.C6H8O7/c15-13-11(7-4-8-12(13)14(16)17)9-10-5-2-1-3-6-10;7-3(8)1-6(13,5(11)12)2-4(9)10/h1-8H,9,15H2,(H2,16,17);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3