(4-cyanophenyl)methyl 2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrole-3-carboxylate

Systemtic Name: (4-cyanophenyl)methyl 2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrole-3-carboxylate Openeye Name: (4-cyanophenyl)methyl 2,5-dimethyl-1-(5-methylisoxazol-3-yl)pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(5-methyl-3-isoxazolyl)-3-pyrrolecarboxylic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-(5-methylisoxazol-3-yl)pyrrole-3-carboxylic acid (4-cyanobenzyl) ester Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=NOC(=C2)C)C)C(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC(=C(N1C2=NOC(=C2)C)C)C(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H17N3O3/c1-12-8-17(14(3)22(12)18-9-13(2)25-21-18)19(23)24-11-16-6-4-15(10-20)5-7-16/h4-9H,11H2,1-3H3