2-cyano-2-(dinaphthalen-1-ylmethyl)butanedioic acid

Systemtic Name: 2-cyano-2-(dinaphthalen-1-ylmethyl)butanedioic acid Openeye Name: 2-[bis(1-naphthyl)methyl]-2-cyano-butanedioic acid CAS Name: 2-[bis(1-naphthalenyl)methyl]-2-cyanobutanedioic acid IUPAC Name: 2-cyano-2-(dinaphthalen-1-ylmethyl)butanedioic acid Traditional Name: 2-[bis(1-naphthyl)methyl]-2-cyano-succinic acid Formula: C26H19NO4 MolecularWeight: 409.43336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(C3=CC=CC4=CC=CC=C43)C(CC(=O)O)(C#N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(C3=CC=CC4=CC=CC=C43)C(CC(=O)O)(C#N)C(=O)O

InChI

InChI=1S/C26H19NO4/c27-16-26(25(30)31,15-23(28)29)24(21-13-5-9-17-7-1-3-11-19(17)21)22-14-6-10-18-8-2-4-12-20(18)22/h1-14,24H,15H2,(H,28,29)(H,30,31)