N-tert-butyl-N-[1,3-diacetyloxy-1-(5-dodec-1-ynylthiophen-2-yl)propyl]carbamate

Systemtic Name: N-tert-butyl-N-[1,3-diacetyloxy-1-(5-dodec-1-ynylthiophen-2-yl)propyl]carbamate Openeye Name: N-tert-butyl-N-[1,3-diacetoxy-1-(5-dodec-1-ynyl-2-thienyl)propyl]carbamate CAS Name: N-tert-butyl-N-[1,3-diacetyloxy-1-(5-dodec-1-ynyl-2-thiophenyl)propyl]carbamate IUPAC Name: N-tert-butyl-N-[1,3-diacetyloxy-1-(5-dodec-1-ynylthiophen-2-yl)propyl]carbamate Traditional Name: N-tert-butyl-N-[1,3-diacetoxy-1-(5-dodec-1-ynyl-2-thienyl)propyl]carbamate Formula: C28H42NO6S- MolecularWeight: 520.70118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H43NO6S/c1-7-8-9-10-11-12-13-14-15-16-17-24-18-19-25(36-24)28(35-23(3)31,20-21-34-22(2)30)29(26(32)33)27(4,5)6/h18-19H,7-15,20-21H2,1-6H3,(H,32,33)/p-1