4-[[1-[2-cyano-2-(3-nitrophenyl)ethenyl]naphthalen-2-yl]oxymethyl]benzoic acid

Systemtic Name: 4-[[1-[2-cyano-2-(3-nitrophenyl)ethenyl]naphthalen-2-yl]oxymethyl]benzoic acid Openeye Name: 4-[[1-[2-cyano-2-(3-nitrophenyl)vinyl]-2-naphthyl]oxymethyl]benzoic acid CAS Name: 4-[[1-[2-cyano-2-(3-nitrophenyl)ethenyl]-2-naphthalenyl]oxymethyl]benzoic acid IUPAC Name: 4-[[1-[2-cyano-2-(3-nitrophenyl)ethenyl]naphthalen-2-yl]oxymethyl]benzoic acid Traditional Name: 4-[[1-[2-cyano-2-(3-nitrophenyl)vinyl]-2-naphthoxy]methyl]benzoic acid Formula: C27H18N2O5 MolecularWeight: 450.44222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2C=C(C#N)C3=CC(=CC=C3)[N+](=O)[O-])OCC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C2C=C(C#N)C3=CC(=CC=C3)[N+](=O)[O-])OCC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C27H18N2O5/c28-16-22(21-5-3-6-23(14-21)29(32)33)15-25-24-7-2-1-4-19(24)12-13-26(25)34-17-18-8-10-20(11-9-18)27(30)31/h1-15H,17H2,(H,30,31)