4-[(4-dodec-1-ynylthiophen-2-yl)methoxymethyl]-2-phenyl-4,5-dihydro-1,3-oxazole

Systemtic Name: 4-[(4-dodec-1-ynylthiophen-2-yl)methoxymethyl]-2-phenyl-4,5-dihydro-1,3-oxazole Openeye Name: 4-[(4-dodec-1-ynyl-2-thienyl)methoxymethyl]-2-phenyl-4,5-dihydrooxazole CAS Name: 4-[(4-dodec-1-ynyl-2-thiophenyl)methoxymethyl]-2-phenyl-4,5-dihydrooxazole IUPAC Name: 4-[(4-dodec-1-ynylthiophen-2-yl)methoxymethyl]-2-phenyl-4,5-dihydro-1,3-oxazole Traditional Name: 4-[(4-dodec-1-ynyl-2-thienyl)methoxymethyl]-2-phenyl-2-oxazoline Formula: C27H35NO2S MolecularWeight: 437.6373

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC#CC1=CSC(=C1)COCC2COC(=N2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCC#CC1=CSC(=C1)COCC2COC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C27H35NO2S/c1-2-3-4-5-6-7-8-9-10-12-15-23-18-26(31-22-23)21-29-19-25-20-30-27(28-25)24-16-13-11-14-17-24/h11,13-14,16-18,22,25H,2-10,19-21H2,1H3