3-(1H-benzimidazol-2-ylamino)-2-butanoyl-cyclohex-2-en-1-one

Systemtic Name: 3-(1H-benzimidazol-2-ylamino)-2-butanoyl-cyclohex-2-en-1-one Openeye Name: 3-(1H-benzimidazol-2-ylamino)-2-butanoyl-cyclohex-2-en-1-one CAS Name: 3-(1H-benzimidazol-2-ylamino)-2-(1-oxobutyl)-1-cyclohex-2-enone IUPAC Name: 3-(1H-benzimidazol-2-ylamino)-2-butanoylcyclohex-2-en-1-one Traditional Name: 3-(1H-benzimidazol-2-ylamino)-2-butyryl-cyclohex-2-en-1-one Formula: C17H19N3O2 MolecularWeight: 297.35166

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(CCCC1=O)NC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCCC(=O)C1=C(CCCC1=O)NC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C17H19N3O2/c1-2-6-14(21)16-13(9-5-10-15(16)22)20-17-18-11-7-3-4-8-12(11)19-17/h3-4,7-8H,2,5-6,9-10H2,1H3,(H2,18,19,20)