5-phenyladamantane-1,3-dicarboxylic acid

Systemtic Name: 5-phenyladamantane-1,3-dicarboxylic acid Openeye Name: 5-phenyladamantane-1,3-dicarboxylic acid CAS Name: 5-phenyladamantane-1,3-dicarboxylic acid IUPAC Name: 5-phenyladamantane-1,3-dicarboxylic acid Traditional Name: 5-phenyladamantane-1,3-dicarboxylic acid Formula: C18H20O4 MolecularWeight: 300.349

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1(CC(C2)(C3)C(=O)O)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1C2CC3(CC1(CC(C2)(C3)C(=O)O)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C18H20O4/c19-14(20)17-7-12-6-16(9-17,13-4-2-1-3-5-13)10-18(8-12,11-17)15(21)22/h1-5,12H,6-11H2,(H,19,20)(H,21,22)