2-[4-(benzamidomethyl)phenyl]propane-1,1,3,3-tetracarboxylic acid

Systemtic Name: 2-[4-(benzamidomethyl)phenyl]propane-1,1,3,3-tetracarboxylic acid Openeye Name: 2-[4-(benzamidomethyl)phenyl]propane-1,1,3,3-tetracarboxylic acid CAS Name: 2-[4-(benzamidomethyl)phenyl]propane-1,1,3,3-tetracarboxylic acid IUPAC Name: 2-[4-(benzamidomethyl)phenyl]propane-1,1,3,3-tetracarboxylic acid Traditional Name: 2-[4-(benzamidomethyl)phenyl]propane-1,1,3,3-tetracarboxylic acid Formula: C21H19NO9 MolecularWeight: 429.37686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)C(C(C(=O)O)C(=O)O)C(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)C(C(C(=O)O)C(=O)O)C(C(=O)O)C(=O)O

InChI

InChI=1S/C21H19NO9/c23-17(13-4-2-1-3-5-13)22-10-11-6-8-12(9-7-11)14(15(18(24)25)19(26)27)16(20(28)29)21(30)31/h1-9,14-16H,10H2,(H,22,23)(H,24,25)(H,26,27)(H,28,29)(H,30,31)