4-[[4-(2-cyano-2-naphthalen-2-yl-ethenyl)-2-ethoxy-6-prop-2-enyl-phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[4-(2-cyano-2-naphthalen-2-yl-ethenyl)-2-ethoxy-6-prop-2-enyl-phenoxy]methyl]benzoic acid Openeye Name: 4-[[2-allyl-4-[2-cyano-2-(2-naphthyl)vinyl]-6-ethoxy-phenoxy]methyl]benzoic acid CAS Name: 4-[[4-[2-cyano-2-(2-naphthalenyl)ethenyl]-2-ethoxy-6-prop-2-enylphenoxy]methyl]benzoic acid IUPAC Name: 4-[[4-(2-cyano-2-naphthalen-2-ylethenyl)-2-ethoxy-6-prop-2-enylphenoxy]methyl]benzoic acid Traditional Name: 4-[[2-allyl-4-[2-cyano-2-(2-naphthyl)vinyl]-6-ethoxy-phenoxy]methyl]benzoic acid Formula: C32H27NO4 MolecularWeight: 489.56108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)C(=O)O)CC=C)C=C(C#N)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)C(=O)O)CC=C)C=C(C#N)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C32H27NO4/c1-3-7-28-16-23(17-29(20-33)27-15-14-24-8-5-6-9-26(24)19-27)18-30(36-4-2)31(28)37-21-22-10-12-25(13-11-22)32(34)35/h3,5-6,8-19H,1,4,7,21H2,2H3,(H,34,35)