ethyl 3,5-dimethyl-4-pent-4-ynoxy-benzoate

Systemtic Name: ethyl 3,5-dimethyl-4-pent-4-ynoxy-benzoate Openeye Name: ethyl 3,5-dimethyl-4-pent-4-ynoxy-benzoate CAS Name: 3,5-dimethyl-4-pent-4-ynoxybenzoic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-pent-4-ynoxybenzoate Traditional Name: 3,5-dimethyl-4-pent-4-ynoxy-benzoic acid ethyl ester Formula: C16H20O3 MolecularWeight: 260.3282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C(=C1)C)OCCCC#C)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C(=C1)C)OCCCC#C)C

InChI

InChI=1S/C16H20O3/c1-5-7-8-9-19-15-12(3)10-14(11-13(15)4)16(17)18-6-2/h1,10-11H,6-9H2,2-4H3