dimethyl 2-[(4-cyanophenyl)methyl]-2-methyl-cyclohexa-3,6-diene-1,3-dicarboxylate

Systemtic Name: dimethyl 2-[(4-cyanophenyl)methyl]-2-methyl-cyclohexa-3,6-diene-1,3-dicarboxylate Openeye Name: dimethyl 2-[(4-cyanophenyl)methyl]-2-methyl-cyclohexa-3,6-diene-1,3-dicarboxylate CAS Name: 2-[(4-cyanophenyl)methyl]-2-methylcyclohexa-3,6-diene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(4-cyanophenyl)methyl]-2-methylcyclohexa-3,6-diene-1,3-dicarboxylate Traditional Name: 2-(4-cyanobenzyl)-2-methyl-cyclohexa-3,6-diene-1,3-dicarboxylic acid dimethyl ester Formula: C19H19NO4 MolecularWeight: 325.35846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=CCC=C1C(=O)OC)C(=O)OC)CC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1(C(=CCC=C1C(=O)OC)C(=O)OC)CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H19NO4/c1-19(11-13-7-9-14(12-20)10-8-13)15(17(21)23-2)5-4-6-16(19)18(22)24-3/h5-10H,4,11H2,1-3H3