4-(5-dodec-1-ynylthiophen-2-yl)-2,2-dimethyl-1,3-dioxan-5-amine

Systemtic Name: 4-(5-dodec-1-ynylthiophen-2-yl)-2,2-dimethyl-1,3-dioxan-5-amine Openeye Name: 4-(5-dodec-1-ynyl-2-thienyl)-2,2-dimethyl-1,3-dioxan-5-amine CAS Name: 4-(5-dodec-1-ynyl-2-thiophenyl)-2,2-dimethyl-1,3-dioxan-5-amine IUPAC Name: 4-(5-dodec-1-ynylthiophen-2-yl)-2,2-dimethyl-1,3-dioxan-5-amine Traditional Name: [4-(5-dodec-1-ynyl-2-thienyl)-2,2-dimethyl-1,3-dioxan-5-yl]amine Formula: C22H35NO2S MolecularWeight: 377.5838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC#CC1=CC=C(S1)C2C(COC(O2)(C)C)N

Isomeric SMILES

CCCCCCCCCCC#CC1=CC=C(S1)C2C(COC(O2)(C)C)N

InChI

InChI=1S/C22H35NO2S/c1-4-5-6-7-8-9-10-11-12-13-14-18-15-16-20(26-18)21-19(23)17-24-22(2,3)25-21/h15-16,19,21H,4-12,17,23H2,1-3H3