tert-butyl 1,4-dimethyl-3-phenyl-pyrrole-2-carboxylate

Systemtic Name: tert-butyl 1,4-dimethyl-3-phenyl-pyrrole-2-carboxylate Openeye Name: tert-butyl 1,4-dimethyl-3-phenyl-pyrrole-2-carboxylate CAS Name: 1,4-dimethyl-3-phenyl-2-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1,4-dimethyl-3-phenylpyrrole-2-carboxylate Traditional Name: 1,4-dimethyl-3-phenyl-pyrrole-2-carboxylic acid tert-butyl ester Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO2/c1-12-11-18(5)15(16(19)20-17(2,3)4)14(12)13-9-7-6-8-10-13/h6-11H,1-5H3