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

Systemtic Name: methyl 5-tert-butyl-2-(4-chlorophenyl)-1-(phenylmethyl)pyrrole-3-carboxylate Openeye Name: methyl 1-benzyl-5-tert-butyl-2-(4-chlorophenyl)pyrrole-3-carboxylate CAS Name: 5-tert-butyl-2-(4-chlorophenyl)-1-(phenylmethyl)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-5-tert-butyl-2-(4-chlorophenyl)pyrrole-3-carboxylate Traditional Name: 1-benzyl-5-tert-butyl-2-(4-chlorophenyl)pyrrole-3-carboxylic acid methyl ester Formula: C23H24ClNO2 MolecularWeight: 381.89516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24ClNO2/c1-23(2,3)20-14-19(22(26)27-4)21(17-10-12-18(24)13-11-17)25(20)15-16-8-6-5-7-9-16/h5-14H,15H2,1-4H3