(2E,4E)-2-cyano-5-(3,4-dipropoxyphenyl)penta-2,4-dienoic acid

Systemtic Name: (2E,4E)-2-cyano-5-(3,4-dipropoxyphenyl)penta-2,4-dienoic acid Openeye Name: (2E,4E)-2-cyano-5-(3,4-dipropoxyphenyl)penta-2,4-dienoic acid CAS Name: (2E,4E)-2-cyano-5-(3,4-dipropoxyphenyl)penta-2,4-dienoic acid IUPAC Name: (2E,4E)-2-cyano-5-(3,4-dipropoxyphenyl)penta-2,4-dienoic acid Traditional Name: (2E,4E)-2-cyano-5-(3,4-dipropoxyphenyl)penta-2,4-dienoic acid Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC=C(C#N)C(=O)O)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C=C(\C#N)/C(=O)O)OCCC

InChI

InChI=1S/C18H21NO4/c1-3-10-22-16-9-8-14(12-17(16)23-11-4-2)6-5-7-15(13-19)18(20)21/h5-9,12H,3-4,10-11H2,1-2H3,(H,20,21)/b6-5+,15-7+