N-tert-butyl-N-[1-(5-dodec-1-ynylthiophen-2-yl)-1,3-bis(oxidanyl)propan-2-yl]carbamate

Systemtic Name: N-tert-butyl-N-[1-(5-dodec-1-ynylthiophen-2-yl)-1,3-bis(oxidanyl)propan-2-yl]carbamate Openeye Name: N-tert-butyl-N-[2-(5-dodec-1-ynyl-2-thienyl)-2-hydroxy-1-(hydroxymethyl)ethyl]carbamate CAS Name: N-tert-butyl-N-[1-(5-dodec-1-ynyl-2-thiophenyl)-1,3-dihydroxypropan-2-yl]carbamate IUPAC Name: N-tert-butyl-N-[1-(5-dodec-1-ynylthiophen-2-yl)-1,3-dihydroxypropan-2-yl]carbamate Traditional Name: N-tert-butyl-N-[2-(5-dodec-1-ynyl-2-thienyl)-2-hydroxy-1-methylol-ethyl]carbamate Formula: C24H38NO4S- MolecularWeight: 436.62782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC#CC1=CC=C(S1)C(C(CO)N(C(=O)[O-])C(C)(C)C)O

Isomeric SMILES

CCCCCCCCCCC#CC1=CC=C(S1)C(C(CO)N(C(=O)[O-])C(C)(C)C)O

InChI

InChI=1S/C24H39NO4S/c1-5-6-7-8-9-10-11-12-13-14-15-19-16-17-21(30-19)22(27)20(18-26)25(23(28)29)24(2,3)4/h16-17,20,22,26-27H,5-13,18H2,1-4H3,(H,28,29)/p-1