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

Systemtic Name: [2-[(5-butyl-2-oxidanylidene-3-propyl-imidazol-1-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[(5-butyl-2-oxo-3-propyl-imidazol-1-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[(5-butyl-2-oxo-3-propyl-1-imidazolyl)methyl]-6-phenylphenyl] ester IUPAC Name: [2-[(5-butyl-2-oxo-3-propylimidazol-1-yl)methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[(5-butyl-2-keto-3-propyl-4-imidazolin-1-yl)methyl]-6-phenyl-phenyl] ester Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN(C(=O)N1CC2=CC=CC(=C2OC(=O)O)C3=CC=CC=C3)CCC

Isomeric SMILES

CCCCC1=CN(C(=O)N1CC2=CC=CC(=C2OC(=O)O)C3=CC=CC=C3)CCC

InChI

InChI=1S/C24H28N2O4/c1-3-5-13-20-17-25(15-4-2)23(27)26(20)16-19-12-9-14-21(22(19)30-24(28)29)18-10-7-6-8-11-18/h6-12,14,17H,3-5,13,15-16H2,1-2H3,(H,28,29)