(E)-2-methyl-1-phenyl-dodec-1-en-5-yne-3,4-dione

Systemtic Name: (E)-2-methyl-1-phenyl-dodec-1-en-5-yne-3,4-dione Openeye Name: (E)-2-methyl-1-phenyl-dodec-1-en-5-yne-3,4-dione CAS Name: (E)-2-methyl-1-phenyldodec-1-en-5-yne-3,4-dione IUPAC Name: (E)-2-methyl-1-phenyldodec-1-en-5-yne-3,4-dione Traditional Name: (E)-2-methyl-1-phenyl-dodec-1-en-5-yne-3,4-dione Formula: C19H22O2 MolecularWeight: 282.37678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC(=O)C(=O)C(=CC1=CC=CC=C1)C

Isomeric SMILES

CCCCCCC#CC(=O)C(=O)/C(=C/C1=CC=CC=C1)/C

InChI

InChI=1S/C19H22O2/c1-3-4-5-6-7-11-14-18(20)19(21)16(2)15-17-12-9-8-10-13-17/h8-10,12-13,15H,3-7H2,1-2H3/b16-15+