2-hydroxyethyl 2-[(1R,3R)-3-(2,4,5-tricyanophenyl)cyclopentyl]ethanoate

Systemtic Name: 2-hydroxyethyl 2-[(1R,3R)-3-(2,4,5-tricyanophenyl)cyclopentyl]ethanoate Openeye Name: 2-hydroxyethyl 2-[(1R,3R)-3-(2,4,5-tricyanophenyl)cyclopentyl]acetate CAS Name: 2-[(1R,3R)-3-(2,4,5-tricyanophenyl)cyclopentyl]acetic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 2-[(1R,3R)-3-(2,4,5-tricyanophenyl)cyclopentyl]acetate Traditional Name: 2-[(1R,3R)-3-(2,4,5-tricyanophenyl)cyclopentyl]acetic acid 2-hydroxyethyl ester Formula: C18H17N3O3 MolecularWeight: 323.34588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC1CC(=O)OCCO)C2=C(C=C(C(=C2)C#N)C#N)C#N

Isomeric SMILES

C1C[C@H](C[C@@H]1CC(=O)OCCO)C2=C(C=C(C(=C2)C#N)C#N)C#N

InChI

InChI=1S/C18H17N3O3/c19-9-14-7-16(11-21)17(8-15(14)10-20)13-2-1-12(5-13)6-18(23)24-4-3-22/h7-8,12-13,22H,1-6H2/t12-,13-/m1/s1