6-[4-[2-[2-(2-oxidanylazulen-6-yl)azulen-6-yl]ethynyl]phenoxy]hexyl prop-2-enoate

Systemtic Name: 6-[4-[2-[2-(2-oxidanylazulen-6-yl)azulen-6-yl]ethynyl]phenoxy]hexyl prop-2-enoate Openeye Name: 6-[4-[2-[2-(2-hydroxyazulen-6-yl)azulen-6-yl]ethynyl]phenoxy]hexyl prop-2-enoate CAS Name: 2-propenoic acid 6-[4-[2-[2-(2-hydroxy-6-azulenyl)-6-azulenyl]ethynyl]phenoxy]hexyl ester IUPAC Name: 6-[4-[2-[2-(2-hydroxyazulen-6-yl)azulen-6-yl]ethynyl]phenoxy]hexyl prop-2-enoate Traditional Name: acrylic acid 6-[4-[2-[2-(2-hydroxyazulen-6-yl)azulen-6-yl]ethynyl]phenoxy]hexyl ester Formula: C37H32O4 MolecularWeight: 540.64758

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OCCCCCCOC1=CC=C(C=C1)C#CC2=CC=C3C=C(C=C3C=C2)C4=CC=C5C=C(C=C5C=C4)O

Isomeric SMILES

C=CC(=O)OCCCCCCOC1=CC=C(C=C1)C#CC2=CC=C3C=C(C=C3C=C2)C4=CC=C5C=C(C=C5C=C4)O

InChI

InChI=1S/C37H32O4/c1-2-37(39)41-22-6-4-3-5-21-40-36-19-11-28(12-20-36)8-7-27-9-13-30-23-34(24-31(30)14-10-27)29-15-17-32-25-35(38)26-33(32)18-16-29/h2,9-20,23-26,38H,1,3-6,21-22H2