2-(2-phenanthren-4-ylethyl)propanedioic acid

Systemtic Name: 2-(2-phenanthren-4-ylethyl)propanedioic acid Openeye Name: 2-[2-(4-phenanthryl)ethyl]propanedioic acid CAS Name: 2-[2-(4-phenanthrenyl)ethyl]propanedioic acid IUPAC Name: 2-(2-phenanthren-4-ylethyl)propanedioic acid Traditional Name: 2-[2-(4-phenanthryl)ethyl]malonic acid Formula: C19H16O4 MolecularWeight: 308.32794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CC=C3)CCC(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CC=C3)CCC(C(=O)O)C(=O)O

InChI

InChI=1S/C19H16O4/c20-18(21)16(19(22)23)11-10-14-6-3-5-13-9-8-12-4-1-2-7-15(12)17(13)14/h1-9,16H,10-11H2,(H,20,21)(H,22,23)