2-[4-[(1,4-dicyano-2H-naphthalen-1-yl)methyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(1,4-dicyano-2H-naphthalen-1-yl)methyl]phenyl]ethanoic acid Openeye Name: 2-[4-[(1,4-dicyano-2H-naphthalen-1-yl)methyl]phenyl]acetic acid CAS Name: 2-[4-[(1,4-dicyano-2H-naphthalen-1-yl)methyl]phenyl]acetic acid IUPAC Name: 2-[4-[(1,4-dicyano-2H-naphthalen-1-yl)methyl]phenyl]acetic acid Traditional Name: 2-[4-[(1,4-dicyano-2H-naphthalen-1-yl)methyl]phenyl]acetic acid Formula: C21H16N2O2 MolecularWeight: 328.36394

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C2=CC=CC=C2C1(CC3=CC=C(C=C3)CC(=O)O)C#N)C#N

Isomeric SMILES

C1C=C(C2=CC=CC=C2C1(CC3=CC=C(C=C3)CC(=O)O)C#N)C#N

InChI

InChI=1S/C21H16N2O2/c22-13-17-9-10-21(14-23,19-4-2-1-3-18(17)19)12-16-7-5-15(6-8-16)11-20(24)25/h1-9H,10-12H2,(H,24,25)