methyl 2-cyano-2-[3-(3-methyl-5-propan-2-yl-phenoxy)quinoxalin-2-yl]ethanoate

Systemtic Name: methyl 2-cyano-2-[3-(3-methyl-5-propan-2-yl-phenoxy)quinoxalin-2-yl]ethanoate Openeye Name: methyl 2-cyano-2-[3-(3-isopropyl-5-methyl-phenoxy)quinoxalin-2-yl]acetate CAS Name: 2-cyano-2-[3-(3-methyl-5-propan-2-ylphenoxy)-2-quinoxalinyl]acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-[3-(3-methyl-5-propan-2-ylphenoxy)quinoxalin-2-yl]acetate Traditional Name: 2-cyano-2-[3-(3-isopropyl-5-methyl-phenoxy)quinoxalin-2-yl]acetic acid methyl ester Formula: C22H21N3O3 MolecularWeight: 375.42044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC3=CC=CC=C3N=C2C(C#N)C(=O)OC)C(C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC3=CC=CC=C3N=C2C(C#N)C(=O)OC)C(C)C

InChI

InChI=1S/C22H21N3O3/c1-13(2)15-9-14(3)10-16(11-15)28-21-20(17(12-23)22(26)27-4)24-18-7-5-6-8-19(18)25-21/h5-11,13,17H,1-4H3