2-(4-dodecoxyphenyl)-6-(4-nonylphenyl)-1,3-benzothiazole

Systemtic Name: 2-(4-dodecoxyphenyl)-6-(4-nonylphenyl)-1,3-benzothiazole Openeye Name: 2-(4-dodecoxyphenyl)-6-(4-nonylphenyl)-1,3-benzothiazole CAS Name: 2-(4-dodecoxyphenyl)-6-(4-nonylphenyl)-1,3-benzothiazole IUPAC Name: 2-(4-dodecoxyphenyl)-6-(4-nonylphenyl)-1,3-benzothiazole Traditional Name: 2-(4-lauryloxyphenyl)-6-(4-nonylphenyl)-1,3-benzothiazole Formula: C40H55NOS MolecularWeight: 597.9358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)C4=CC=C(C=C4)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)C4=CC=C(C=C4)CCCCCCCCC

InChI

InChI=1S/C40H55NOS/c1-3-5-7-9-11-12-13-15-17-19-31-42-37-28-25-35(26-29-37)40-41-38-30-27-36(32-39(38)43-40)34-23-21-33(22-24-34)20-18-16-14-10-8-6-4-2/h21-30,32H,3-20,31H2,1-2H3