dodec-9-ynyl 4-chloranylbenzoate

Systemtic Name: dodec-9-ynyl 4-chloranylbenzoate Openeye Name: dodec-9-ynyl 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid dodec-9-ynyl ester IUPAC Name: dodec-9-ynyl 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid dodec-9-ynyl ester Formula: C19H25ClO2 MolecularWeight: 320.8536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC#CCCCCCCCCOC(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CCC#CCCCCCCCCOC(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C19H25ClO2/c1-2-3-4-5-6-7-8-9-10-11-16-22-19(21)17-12-14-18(20)15-13-17/h12-15H,2,5-11,16H2,1H3