2-(2-cyanoethyl)-2-naphthalen-1-yloxy-propanedioic acid

Systemtic Name: 2-(2-cyanoethyl)-2-naphthalen-1-yloxy-propanedioic acid Openeye Name: 2-(2-cyanoethyl)-2-(1-naphthyloxy)propanedioic acid CAS Name: 2-(2-cyanoethyl)-2-(1-naphthalenyloxy)propanedioic acid IUPAC Name: 2-(2-cyanoethyl)-2-naphthalen-1-yloxypropanedioic acid Traditional Name: 2-(2-cyanoethyl)-2-(1-naphthoxy)malonic acid Formula: C16H13NO5 MolecularWeight: 299.27812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2OC(CCC#N)(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2OC(CCC#N)(C(=O)O)C(=O)O

InChI

InChI=1S/C16H13NO5/c17-10-4-9-16(14(18)19,15(20)21)22-13-8-3-6-11-5-1-2-7-12(11)13/h1-3,5-8H,4,9H2,(H,18,19)(H,20,21)