3-chloranyl-4-phenyl-1-(2-phenylimidazol-1-yl)isoquinoline; ethanedioic acid

Systemtic Name: 3-chloranyl-4-phenyl-1-(2-phenylimidazol-1-yl)isoquinoline; ethanedioic acid Openeye Name: 3-chloro-4-phenyl-1-(2-phenylimidazol-1-yl)isoquinoline; oxalic acid CAS Name: 3-chloro-4-phenyl-1-(2-phenyl-1-imidazolyl)isoquinoline; oxalic acid IUPAC Name: 3-chloro-4-phenyl-1-(2-phenylimidazol-1-yl)isoquinoline; oxalic acid Traditional Name: 3-chloro-4-phenyl-1-(2-phenylimidazol-1-yl)isoquinoline; oxalic acid Formula: C26H18ClN3O4 MolecularWeight: 471.89182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(C3=CC=CC=C32)N4C=CN=C4C5=CC=CC=C5)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(C3=CC=CC=C32)N4C=CN=C4C5=CC=CC=C5)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H16ClN3.C2H2O4/c25-22-21(17-9-3-1-4-10-17)19-13-7-8-14-20(19)24(27-22)28-16-15-26-23(28)18-11-5-2-6-12-18;3-1(4)2(5)6/h1-16H;(H,3,4)(H,5,6)