O1-butyl O2-hex-4-yn-3-yl benzene-1,2-dicarboxylate

Systemtic Name: O1-butyl O2-hex-4-yn-3-yl benzene-1,2-dicarboxylate Openeye Name: O1-butyl O2-(1-ethylbut-2-ynyl) benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid O1-butyl ester O2-hex-4-yn-3-yl ester IUPAC Name: 1-O-butyl 2-O-hex-4-yn-3-yl benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid O1-butyl ester O2-(1-ethylbut-2-ynyl) ester Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=CC=C1C(=O)OC(CC)C#CC

Isomeric SMILES

CCCCOC(=O)C1=CC=CC=C1C(=O)OC(CC)C#CC

InChI

InChI=1S/C18H22O4/c1-4-7-13-21-17(19)15-11-8-9-12-16(15)18(20)22-14(6-3)10-5-2/h8-9,11-12,14H,4,6-7,13H2,1-3H3