ethyl (E)-11-chloranyl-3,7,11-trimethyl-10-phenylsulfanyl-dodec-2-enoate

Systemtic Name: ethyl (E)-11-chloranyl-3,7,11-trimethyl-10-phenylsulfanyl-dodec-2-enoate Openeye Name: ethyl (E)-11-chloro-3,7,11-trimethyl-10-phenylsulfanyl-dodec-2-enoate CAS Name: (E)-11-chloro-3,7,11-trimethyl-10-(phenylthio)-2-dodecenoic acid ethyl ester IUPAC Name: ethyl (E)-11-chloro-3,7,11-trimethyl-10-phenylsulfanyldodec-2-enoate Traditional Name: (E)-11-chloro-3,7,11-trimethyl-10-(phenylthio)dodec-2-enoic acid ethyl ester Formula: C23H35ClO2S MolecularWeight: 411.0408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)CCCC(C)CCC(C(C)(C)Cl)SC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)/C=C(\C)/CCCC(C)CCC(C(C)(C)Cl)SC1=CC=CC=C1

InChI

InChI=1S/C23H35ClO2S/c1-6-26-22(25)17-19(3)12-10-11-18(2)15-16-21(23(4,5)24)27-20-13-8-7-9-14-20/h7-9,13-14,17-18,21H,6,10-12,15-16H2,1-5H3/b19-17+