dimethyl 9-[1,3-bis(4-octoxyphenyl)prop-2-ynylidene]fluorene-2,7-dicarboxylate

Systemtic Name: dimethyl 9-[1,3-bis(4-octoxyphenyl)prop-2-ynylidene]fluorene-2,7-dicarboxylate Openeye Name: dimethyl 9-[1,3-bis(4-octoxyphenyl)prop-2-ynylidene]fluorene-2,7-dicarboxylate CAS Name: 9-[1,3-bis(4-octoxyphenyl)prop-2-ynylidene]fluorene-2,7-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 9-[1,3-bis(4-octoxyphenyl)prop-2-ynylidene]fluorene-2,7-dicarboxylate Traditional Name: 9-[1,3-bis(4-octoxyphenyl)prop-2-ynylidene]fluorene-2,7-dicarboxylic acid dimethyl ester Formula: C48H54O6 MolecularWeight: 726.93876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C#CC(=C2C3=C(C=CC(=C3)C(=O)OC)C4=C2C=C(C=C4)C(=O)OC)C5=CC=C(C=C5)OCCCCCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C#CC(=C2C3=C(C=CC(=C3)C(=O)OC)C4=C2C=C(C=C4)C(=O)OC)C5=CC=C(C=C5)OCCCCCCCC

InChI

InChI=1S/C48H54O6/c1-5-7-9-11-13-15-31-53-39-24-17-35(18-25-39)19-28-41(36-20-26-40(27-21-36)54-32-16-14-12-10-8-6-2)46-44-33-37(47(49)51-3)22-29-42(44)43-30-23-38(34-45(43)46)48(50)52-4/h17-18,20-27,29-30,33-34H,5-16,31-32H2,1-4H3