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

Systemtic Name: sodium 3-[4,5-bis(4-chlorophenyl)-4,5-dihydro-1H-imidazol-2-yl]-4-methoxy-benzoate Openeye Name: sodium 3-[4,5-bis(4-chlorophenyl)-4,5-dihydro-1H-imidazol-2-yl]-4-methoxy-benzoate CAS Name: sodium 3-[4,5-bis(4-chlorophenyl)-4,5-dihydro-1H-imidazol-2-yl]-4-methoxybenzoate IUPAC Name: sodium 3-[4,5-bis(4-chlorophenyl)-4,5-dihydro-1H-imidazol-2-yl]-4-methoxybenzoate Traditional Name: sodium 3-[4,5-bis(4-chlorophenyl)-2-imidazolin-2-yl]-4-methoxy-benzoate Formula: C23H17Cl2N2NaO3 MolecularWeight: 463.28845

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)[O-])C2=NC(C(N2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl.[Na+]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)[O-])C2=NC(C(N2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl.[Na+]

InChI

InChI=1S/C23H18Cl2N2O3.Na/c1-30-19-11-6-15(23(28)29)12-18(19)22-26-20(13-2-7-16(24)8-3-13)21(27-22)14-4-9-17(25)10-5-14;/h2-12,20-21H,1H3,(H,26,27)(H,28,29);/q;+1/p-1