[5-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-2-phenyl-1H-imidazol-4-yl] hydrogen carbonate

Systemtic Name: [5-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-2-phenyl-1H-imidazol-4-yl] hydrogen carbonate Openeye Name: [5-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-2-phenyl-1H-imidazol-4-yl] hydrogen carbonate CAS Name: carbonic acid [5-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-2-phenyl-1H-imidazol-4-yl] ester IUPAC Name: [5-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-2-phenyl-1H-imidazol-4-yl] hydrogen carbonate Traditional Name: carbonic acid [5-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-2-phenyl-1H-imidazol-4-yl] ester Formula: C18H13ClN2O5 MolecularWeight: 372.75922

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CC3=C(N=C(N3)C4=CC=CC=C4)OC(=O)O)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CC3=C(N=C(N3)C4=CC=CC=C4)OC(=O)O)Cl

InChI

InChI=1S/C18H13ClN2O5/c19-12-8-15-14(24-9-25-15)7-11(12)6-13-17(26-18(22)23)21-16(20-13)10-4-2-1-3-5-10/h1-5,7-8H,6,9H2,(H,20,21)(H,22,23)