1-[(4-methylphenyl)methyl]-2-oxidanylidene-3H-benzimidazole-5-carboxylate

Systemtic Name: 1-[(4-methylphenyl)methyl]-2-oxidanylidene-3H-benzimidazole-5-carboxylate Openeye Name: 2-oxo-1-(p-tolylmethyl)-3H-benzimidazole-5-carboxylate CAS Name: 1-[(4-methylphenyl)methyl]-2-oxo-3H-benzimidazole-5-carboxylate IUPAC Name: 1-[(4-methylphenyl)methyl]-2-oxo-3H-benzimidazole-5-carboxylate Traditional Name: 2-keto-1-(4-methylbenzyl)-3H-benzimidazole-5-carboxylate Formula: C16H13N2O3- MolecularWeight: 281.28602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)C(=O)[O-])NC2=O

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)C(=O)[O-])NC2=O

InChI

InChI=1S/C16H14N2O3/c1-10-2-4-11(5-3-10)9-18-14-7-6-12(15(19)20)8-13(14)17-16(18)21/h2-8H,9H2,1H3,(H,17,21)(H,19,20)/p-1