2-hydroxyethyl 2-methyl-6-(2,4,5-tricyanophenyl)hexanoate

Systemtic Name: 2-hydroxyethyl 2-methyl-6-(2,4,5-tricyanophenyl)hexanoate Openeye Name: 2-hydroxyethyl 2-methyl-6-(2,4,5-tricyanophenyl)hexanoate CAS Name: 2-methyl-6-(2,4,5-tricyanophenyl)hexanoic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 2-methyl-6-(2,4,5-tricyanophenyl)hexanoate Traditional Name: 2-methyl-6-(2,4,5-tricyanophenyl)hexanoic acid 2-hydroxyethyl ester Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCC1=C(C=C(C(=C1)C#N)C#N)C#N)C(=O)OCCO

Isomeric SMILES

CC(CCCCC1=C(C=C(C(=C1)C#N)C#N)C#N)C(=O)OCCO

InChI

InChI=1S/C18H19N3O3/c1-13(18(23)24-7-6-22)4-2-3-5-14-8-16(11-20)17(12-21)9-15(14)10-19/h8-9,13,22H,2-7H2,1H3