O1-(2-cyanoprop-2-enyl) O4-nona-1,8-dien-5-yl benzene-1,4-dicarboxylate

Systemtic Name: O1-(2-cyanoprop-2-enyl) O4-nona-1,8-dien-5-yl benzene-1,4-dicarboxylate Openeye Name: O4-(1-but-3-enylpent-4-enyl) O1-(2-cyanoallyl) benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O1-(2-cyanoprop-2-enyl) ester O4-nona-1,8-dien-5-yl ester IUPAC Name: 1-O-(2-cyanoprop-2-enyl) 4-O-nona-1,8-dien-5-yl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-(1-but-3-enylpent-4-enyl) ester O1-(2-cyanoallyl) ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC(CCC=C)OC(=O)C1=CC=C(C=C1)C(=O)OCC(=C)C#N

Isomeric SMILES

C=CCCC(CCC=C)OC(=O)C1=CC=C(C=C1)C(=O)OCC(=C)C#N

InChI

InChI=1S/C21H23NO4/c1-4-6-8-19(9-7-5-2)26-21(24)18-12-10-17(11-13-18)20(23)25-15-16(3)14-22/h4-5,10-13,19H,1-3,6-9,15H2