[2-[(2-oxidanylidene-3-phenethyl-5-propyl-imidazol-1-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [2-[(2-oxidanylidene-3-phenethyl-5-propyl-imidazol-1-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[(2-oxo-3-phenethyl-5-propyl-imidazol-1-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[(2-oxo-3-phenethyl-5-propyl-1-imidazolyl)methyl]-6-phenylphenyl] ester IUPAC Name: [2-[(2-oxo-3-phenethyl-5-propylimidazol-1-yl)methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[(2-keto-3-phenethyl-5-propyl-4-imidazolin-1-yl)methyl]-6-phenyl-phenyl] ester Formula: C28H28N2O4 MolecularWeight: 456.53292

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CN(C(=O)N1CC2=CC=CC(=C2OC(=O)O)C3=CC=CC=C3)CCC4=CC=CC=C4

Isomeric SMILES

CCCC1=CN(C(=O)N1CC2=CC=CC(=C2OC(=O)O)C3=CC=CC=C3)CCC4=CC=CC=C4

InChI

InChI=1S/C28H28N2O4/c1-2-10-24-20-29(18-17-21-11-5-3-6-12-21)27(31)30(24)19-23-15-9-16-25(26(23)34-28(32)33)22-13-7-4-8-14-22/h3-9,11-16,20H,2,10,17-19H2,1H3,(H,32,33)