N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-9-oxidanylidene-bicyclo[3.3.1]nonane-3-carboxamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-9-oxidanylidene-bicyclo[3.3.1]nonane-3-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-9-oxo-bicyclo[3.3.1]nonane-3-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-9-oxo-3-bicyclo[3.3.1]nonanecarboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenylethyl]-9-oxobicyclo[3.3.1]nonane-3-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-2-phenyl-ethyl]-9-keto-bicyclo[3.3.1]nonane-3-carboxamide Formula: C25H27N3O2 MolecularWeight: 401.50078

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC(C1)C2=O)C(=O)NC(CC3=CC=CC=C3)C4=NC5=CC=CC=C5N4

Isomeric SMILES

C1CC2CC(CC(C1)C2=O)C(=O)N[C@@H](CC3=CC=CC=C3)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C25H27N3O2/c29-23-17-9-6-10-18(23)15-19(14-17)25(30)28-22(13-16-7-2-1-3-8-16)24-26-20-11-4-5-12-21(20)27-24/h1-5,7-8,11-12,17-19,22H,6,9-10,13-15H2,(H,26,27)(H,28,30)/t17?,18?,19?,22-/m0/s1