2-methyl-1-(phenylmethyl)-5-thiophen-2-yl-pyrrole-3-carboxylic acid

Systemtic Name: 2-methyl-1-(phenylmethyl)-5-thiophen-2-yl-pyrrole-3-carboxylic acid Openeye Name: 1-benzyl-2-methyl-5-(2-thienyl)pyrrole-3-carboxylic acid CAS Name: 2-methyl-1-(phenylmethyl)-5-thiophen-2-yl-3-pyrrolecarboxylic acid IUPAC Name: 1-benzyl-2-methyl-5-thiophen-2-ylpyrrole-3-carboxylic acid Traditional Name: 1-benzyl-2-methyl-5-(2-thienyl)pyrrole-3-carboxylic acid Formula: C17H15NO2S MolecularWeight: 297.3715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CC2=CC=CC=C2)C3=CC=CS3)C(=O)O

Isomeric SMILES

CC1=C(C=C(N1CC2=CC=CC=C2)C3=CC=CS3)C(=O)O

InChI

InChI=1S/C17H15NO2S/c1-12-14(17(19)20)10-15(16-8-5-9-21-16)18(12)11-13-6-3-2-4-7-13/h2-10H,11H2,1H3,(H,19,20)