7-phenyladamantane-1,3,5-tricarboxylic acid

Systemtic Name: 7-phenyladamantane-1,3,5-tricarboxylic acid Openeye Name: 7-phenyladamantane-1,3,5-tricarboxylic acid CAS Name: 7-phenyladamantane-1,3,5-tricarboxylic acid IUPAC Name: 7-phenyladamantane-1,3,5-tricarboxylic acid Traditional Name: 7-phenyladamantane-1,3,5-tricarboxylic acid Formula: C19H20O6 MolecularWeight: 344.3585

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Descriptors Computed from Structure

Canonical SMILES:

C1C2(CC3(CC1(CC(C2)(C3)C(=O)O)C(=O)O)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1C2(CC3(CC1(CC(C2)(C3)C(=O)O)C(=O)O)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C19H20O6/c20-13(21)17-6-16(12-4-2-1-3-5-12)7-18(9-17,14(22)23)11-19(8-16,10-17)15(24)25/h1-5H,6-11H2,(H,20,21)(H,22,23)(H,24,25)