4-[1-cyano-2-[3-methoxy-4-(naphthalen-2-ylmethoxy)phenyl]ethenyl]benzoic acid

Systemtic Name: 4-[1-cyano-2-[3-methoxy-4-(naphthalen-2-ylmethoxy)phenyl]ethenyl]benzoic acid Openeye Name: 4-[1-cyano-2-[3-methoxy-4-(2-naphthylmethoxy)phenyl]vinyl]benzoic acid CAS Name: 4-[1-cyano-2-[3-methoxy-4-(2-naphthalenylmethoxy)phenyl]ethenyl]benzoic acid IUPAC Name: 4-[1-cyano-2-[3-methoxy-4-(naphthalen-2-ylmethoxy)phenyl]ethenyl]benzoic acid Traditional Name: 4-[1-cyano-2-[3-methoxy-4-(2-naphthylmethoxy)phenyl]vinyl]benzoic acid Formula: C28H21NO4 MolecularWeight: 435.47064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)O)OCC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)O)OCC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C28H21NO4/c1-32-27-16-19(14-25(17-29)22-9-11-23(12-10-22)28(30)31)7-13-26(27)33-18-20-6-8-21-4-2-3-5-24(21)15-20/h2-16H,18H2,1H3,(H,30,31)