1-[(4-chlorophenyl)methyl]-4-(4-phenylmethoxyphenyl)pyrrole-2-carboxylic acid

Systemtic Name: 1-[(4-chlorophenyl)methyl]-4-(4-phenylmethoxyphenyl)pyrrole-2-carboxylic acid Openeye Name: 4-(4-benzyloxyphenyl)-1-[(4-chlorophenyl)methyl]pyrrole-2-carboxylic acid CAS Name: 1-[(4-chlorophenyl)methyl]-4-(4-phenylmethoxyphenyl)-2-pyrrolecarboxylic acid IUPAC Name: 1-[(4-chlorophenyl)methyl]-4-(4-phenylmethoxyphenyl)pyrrole-2-carboxylic acid Traditional Name: 4-(4-benzoxyphenyl)-1-(4-chlorobenzyl)pyrrole-2-carboxylic acid Formula: C25H20ClNO3 MolecularWeight: 417.8842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=CN(C(=C3)C(=O)O)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=CN(C(=C3)C(=O)O)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H20ClNO3/c26-22-10-6-18(7-11-22)15-27-16-21(14-24(27)25(28)29)20-8-12-23(13-9-20)30-17-19-4-2-1-3-5-19/h1-14,16H,15,17H2,(H,28,29)