[3-(1,3-dihydrobenzimidazol-2-ylidene)-4-methoxy-2,4-bis(oxidanylidene)butyl] 3-oxidanyladamantane-1-carboxylate

Systemtic Name: [3-(1,3-dihydrobenzimidazol-2-ylidene)-4-methoxy-2,4-bis(oxidanylidene)butyl] 3-oxidanyladamantane-1-carboxylate Openeye Name: [3-(1,3-dihydrobenzimidazol-2-ylidene)-4-methoxy-2,4-dioxo-butyl] 3-hydroxyadamantane-1-carboxylate CAS Name: 3-hydroxy-1-adamantanecarboxylic acid [3-(1,3-dihydrobenzimidazol-2-ylidene)-4-methoxy-2,4-dioxobutyl] ester IUPAC Name: [3-(1,3-dihydrobenzimidazol-2-ylidene)-4-methoxy-2,4-dioxobutyl] 3-hydroxyadamantane-1-carboxylate Traditional Name: 3-hydroxyadamantane-1-carboxylic acid [3-(1,3-dihydrobenzimidazol-2-ylidene)-2,4-diketo-4-methoxy-butyl] ester Formula: C23H26N2O6 MolecularWeight: 426.46234

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C1NC2=CC=CC=C2N1)C(=O)COC(=O)C34CC5CC(C3)CC(C5)(C4)O

Isomeric SMILES

COC(=O)C(=C1NC2=CC=CC=C2N1)C(=O)COC(=O)C34CC5CC(C3)CC(C5)(C4)O

InChI

InChI=1S/C23H26N2O6/c1-30-20(27)18(19-24-15-4-2-3-5-16(15)25-19)17(26)11-31-21(28)22-7-13-6-14(8-22)10-23(29,9-13)12-22/h2-5,13-14,24-25,29H,6-12H2,1H3