tert-butyl 3-(4-methoxyphenyl)-1,4-dimethyl-pyrrole-2-carboxylate

Systemtic Name: tert-butyl 3-(4-methoxyphenyl)-1,4-dimethyl-pyrrole-2-carboxylate Openeye Name: tert-butyl 3-(4-methoxyphenyl)-1,4-dimethyl-pyrrole-2-carboxylate CAS Name: 3-(4-methoxyphenyl)-1,4-dimethyl-2-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(4-methoxyphenyl)-1,4-dimethylpyrrole-2-carboxylate Traditional Name: 3-(4-methoxyphenyl)-1,4-dimethyl-pyrrole-2-carboxylic acid tert-butyl ester Formula: C18H23NO3 MolecularWeight: 301.38012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=C1C2=CC=C(C=C2)OC)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=CN(C(=C1C2=CC=C(C=C2)OC)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C18H23NO3/c1-12-11-19(5)16(17(20)22-18(2,3)4)15(12)13-7-9-14(21-6)10-8-13/h7-11H,1-6H3