dimethyl 2-[(2-hex-1-ynylphenyl)methylidene]propanedioate

Systemtic Name: dimethyl 2-[(2-hex-1-ynylphenyl)methylidene]propanedioate Openeye Name: dimethyl 2-[(2-hex-1-ynylphenyl)methylene]propanedioate CAS Name: 2-[(2-hex-1-ynylphenyl)methylidene]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(2-hex-1-ynylphenyl)methylidene]propanedioate Traditional Name: 2-(2-hex-1-ynylbenzylidene)malonic acid dimethyl ester Formula: C18H20O4 MolecularWeight: 300.349

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CC=CC=C1C=C(C(=O)OC)C(=O)OC

Isomeric SMILES

CCCCC#CC1=CC=CC=C1C=C(C(=O)OC)C(=O)OC

InChI

InChI=1S/C18H20O4/c1-4-5-6-7-10-14-11-8-9-12-15(14)13-16(17(19)21-2)18(20)22-3/h8-9,11-13H,4-6H2,1-3H3