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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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