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

Systemtic Name: N-[1-(5-dodec-1-ynylthiophen-2-yl)-1,3-bis(oxidanyl)propyl]carbamate Openeye Name: N-[1-(5-dodec-1-ynyl-2-thienyl)-1,3-dihydroxy-propyl]carbamate CAS Name: N-[1-(5-dodec-1-ynyl-2-thiophenyl)-1,3-dihydroxypropyl]carbamate IUPAC Name: N-[1-(5-dodec-1-ynylthiophen-2-yl)-1,3-dihydroxypropyl]carbamate Traditional Name: N-[1-(5-dodec-1-ynyl-2-thienyl)-1,3-dihydroxy-propyl]carbamate Formula: C20H30NO4S- MolecularWeight: 380.5215

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC#CC1=CC=C(S1)C(CCO)(NC(=O)[O-])O

Isomeric SMILES

CCCCCCCCCCC#CC1=CC=C(S1)C(CCO)(NC(=O)[O-])O

InChI

InChI=1S/C20H31NO4S/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-14-18(26-17)20(25,15-16-22)21-19(23)24/h13-14,21-22,25H,2-10,15-16H2,1H3,(H,23,24)/p-1