methyl 5-tert-butyl-2,4-diphenyl-1-(phenylmethyl)pyrrole-3-carboxylate

Systemtic Name: methyl 5-tert-butyl-2,4-diphenyl-1-(phenylmethyl)pyrrole-3-carboxylate Openeye Name: methyl 1-benzyl-5-tert-butyl-2,4-diphenyl-pyrrole-3-carboxylate CAS Name: 5-tert-butyl-2,4-diphenyl-1-(phenylmethyl)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-5-tert-butyl-2,4-diphenylpyrrole-3-carboxylate Traditional Name: 1-benzyl-5-tert-butyl-2,4-diphenyl-pyrrole-3-carboxylic acid methyl ester Formula: C29H29NO2 MolecularWeight: 423.54606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=C(N1CC2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=C(C(=C(N1CC2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C29H29NO2/c1-29(2,3)27-24(22-16-10-6-11-17-22)25(28(31)32-4)26(23-18-12-7-13-19-23)30(27)20-21-14-8-5-9-15-21/h5-19H,20H2,1-4H3