4-[(3,4-dichlorophenyl)methyl]-1-methyl-pyrrolo[2,3-d]imidazole-5-carboxylic acid

Systemtic Name: 4-[(3,4-dichlorophenyl)methyl]-1-methyl-pyrrolo[2,3-d]imidazole-5-carboxylic acid Openeye Name: 4-[(3,4-dichlorophenyl)methyl]-1-methyl-pyrrolo[2,3-d]imidazole-5-carboxylic acid CAS Name: 4-[(3,4-dichlorophenyl)methyl]-1-methyl-5-pyrrolo[2,3-d]imidazolecarboxylic acid IUPAC Name: 4-[(3,4-dichlorophenyl)methyl]-1-methylpyrrolo[2,3-d]imidazole-5-carboxylic acid Traditional Name: 4-(3,4-dichlorobenzyl)-1-methyl-pyrrol[2,3-d]imidazole-5-carboxylic acid Formula: C14H11Cl2N3O2 MolecularWeight: 324.16204

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C=C(N2CC3=CC(=C(C=C3)Cl)Cl)C(=O)O

Isomeric SMILES

CN1C=NC2=C1C=C(N2CC3=CC(=C(C=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C14H11Cl2N3O2/c1-18-7-17-13-11(18)5-12(14(20)21)19(13)6-8-2-3-9(15)10(16)4-8/h2-5,7H,6H2,1H3,(H,20,21)