4-[[(1,5-dimethylpyrrol-2-yl)carbonylamino]methyl]benzoate

Systemtic Name: 4-[[(1,5-dimethylpyrrol-2-yl)carbonylamino]methyl]benzoate Openeye Name: 4-[[(1,5-dimethylpyrrole-2-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[(1,5-dimethyl-2-pyrrolyl)-oxomethyl]amino]methyl]benzoate IUPAC Name: 4-[[(1,5-dimethylpyrrole-2-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(1,5-dimethylpyrrole-2-carbonyl)amino]methyl]benzoate Formula: C15H15N2O3- MolecularWeight: 271.2912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C)C(=O)NCC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(N1C)C(=O)NCC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C15H16N2O3/c1-10-3-8-13(17(10)2)14(18)16-9-11-4-6-12(7-5-11)15(19)20/h3-8H,9H2,1-2H3,(H,16,18)(H,19,20)/p-1