3-[2-(1H-benzimidazol-2-yl)ethylamino]-5,5-dimethyl-2-propanoyl-cyclohex-2-en-1-one

Systemtic Name: 3-[2-(1H-benzimidazol-2-yl)ethylamino]-5,5-dimethyl-2-propanoyl-cyclohex-2-en-1-one Openeye Name: 3-[2-(1H-benzimidazol-2-yl)ethylamino]-5,5-dimethyl-2-propanoyl-cyclohex-2-en-1-one CAS Name: 3-[2-(1H-benzimidazol-2-yl)ethylamino]-5,5-dimethyl-2-(1-oxopropyl)-1-cyclohex-2-enone IUPAC Name: 3-[2-(1H-benzimidazol-2-yl)ethylamino]-5,5-dimethyl-2-propanoylcyclohex-2-en-1-one Traditional Name: 3-[2-(1H-benzimidazol-2-yl)ethylamino]-5,5-dimethyl-2-propionyl-cyclohex-2-en-1-one Formula: C20H25N3O2 MolecularWeight: 339.4314

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(CC(CC1=O)(C)C)NCCC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCC(=O)C1=C(CC(CC1=O)(C)C)NCCC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C20H25N3O2/c1-4-16(24)19-15(11-20(2,3)12-17(19)25)21-10-9-18-22-13-7-5-6-8-14(13)23-18/h5-8,21H,4,9-12H2,1-3H3,(H,22,23)