methyl 4-(4-tert-butylphenyl)carbonyl-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-(4-tert-butylphenyl)carbonyl-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-(4-tert-butylbenzoyl)-1H-pyrrole-2-carboxylate CAS Name: 4-[(4-tert-butylphenyl)-oxomethyl]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-tert-butylbenzoyl)-1H-pyrrole-2-carboxylate Traditional Name: 4-(4-tert-butylbenzoyl)-1H-pyrrole-2-carboxylic acid methyl ester Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C2=CNC(=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)C2=CNC(=C2)C(=O)OC

InChI

InChI=1S/C17H19NO3/c1-17(2,3)13-7-5-11(6-8-13)15(19)12-9-14(18-10-12)16(20)21-4/h5-10,18H,1-4H3