ethyl (E)-3-(3-dodec-1-ynylphenyl)prop-2-enoate

Systemtic Name: ethyl (E)-3-(3-dodec-1-ynylphenyl)prop-2-enoate Openeye Name: ethyl (E)-3-(3-dodec-1-ynylphenyl)prop-2-enoate CAS Name: (E)-3-(3-dodec-1-ynylphenyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(3-dodec-1-ynylphenyl)prop-2-enoate Traditional Name: (E)-3-(3-dodec-1-ynylphenyl)acrylic acid ethyl ester Formula: C23H32O2 MolecularWeight: 340.49898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC#CC1=CC(=CC=C1)C=CC(=O)OCC

Isomeric SMILES

CCCCCCCCCCC#CC1=CC(=CC=C1)/C=C/C(=O)OCC

InChI

InChI=1S/C23H32O2/c1-3-5-6-7-8-9-10-11-12-13-15-21-16-14-17-22(20-21)18-19-23(24)25-4-2/h14,16-20H,3-12H2,1-2H3/b19-18+