methyl 5-[2-(benzimidazol-1-yl)ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[2-(benzimidazol-1-yl)ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[2-(benzimidazol-1-yl)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-(1-benzimidazolyl)-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[2-(benzimidazol-1-yl)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(benzimidazol-1-yl)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)CN2C=NC3=CC=CC=C32

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)CN2C=NC3=CC=CC=C32

InChI

InChI=1S/C17H17N3O3/c1-10-15(17(22)23-3)11(2)19-16(10)14(21)8-20-9-18-12-6-4-5-7-13(12)20/h4-7,9,19H,8H2,1-3H3