ethyl (2E,4E)-4-[(4-cyanophenyl)-oxidanyl-methyl]-2-methyl-hexa-2,4-dienoate

Systemtic Name: ethyl (2E,4E)-4-[(4-cyanophenyl)-oxidanyl-methyl]-2-methyl-hexa-2,4-dienoate Openeye Name: ethyl (2E,4E)-4-[(4-cyanophenyl)-hydroxy-methyl]-2-methyl-hexa-2,4-dienoate CAS Name: (2E,4E)-4-[(4-cyanophenyl)-hydroxymethyl]-2-methylhexa-2,4-dienoic acid ethyl ester IUPAC Name: ethyl (2E,4E)-4-[(4-cyanophenyl)-hydroxymethyl]-2-methylhexa-2,4-dienoate Traditional Name: (2E,4E)-4-[(4-cyanophenyl)-hydroxy-methyl]-2-methyl-hexa-2,4-dienoic acid ethyl ester Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)/C(=C/C(=C\C)/C(C1=CC=C(C=C1)C#N)O)/C

InChI

InChI=1S/C17H19NO3/c1-4-14(10-12(3)17(20)21-5-2)16(19)15-8-6-13(11-18)7-9-15/h4,6-10,16,19H,5H2,1-3H3/b12-10+,14-4+