sodium 3-[4,5-bis(4-chlorophenyl)-4,5-dihydro-1H-imidazol-2-yl]benzoate

Systemtic Name: sodium 3-[4,5-bis(4-chlorophenyl)-4,5-dihydro-1H-imidazol-2-yl]benzoate Openeye Name: sodium 3-[4,5-bis(4-chlorophenyl)-4,5-dihydro-1H-imidazol-2-yl]benzoate CAS Name: sodium 3-[4,5-bis(4-chlorophenyl)-4,5-dihydro-1H-imidazol-2-yl]benzoate IUPAC Name: sodium 3-[4,5-bis(4-chlorophenyl)-4,5-dihydro-1H-imidazol-2-yl]benzoate Traditional Name: sodium 3-[4,5-bis(4-chlorophenyl)-2-imidazolin-2-yl]benzoate Formula: C22H15Cl2N2NaO2 MolecularWeight: 433.26247

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)[O-])C2=NC(C(N2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl.[Na+]

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)[O-])C2=NC(C(N2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl.[Na+]

InChI

InChI=1S/C22H16Cl2N2O2.Na/c23-17-8-4-13(5-9-17)19-20(14-6-10-18(24)11-7-14)26-21(25-19)15-2-1-3-16(12-15)22(27)28;/h1-12,19-20H,(H,25,26)(H,27,28);/q;+1/p-1