N-[2-[(4-fluorophenyl)methylcarbamoylamino]cyclohexyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[(4-fluorophenyl)methylcarbamoylamino]cyclohexyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[(4-fluorophenyl)methylcarbamoylamino]cyclohexyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[[[(4-fluorophenyl)methylamino]-oxomethyl]amino]cyclohexyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[(4-fluorophenyl)methylcarbamoylamino]cyclohexyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[(4-fluorobenzyl)carbamoylamino]cyclohexyl]-piperonylamide Formula: C22H24FN3O4 MolecularWeight: 413.442063

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)NC(=O)C2=CC3=C(C=C2)OCO3)NC(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1CCC(C(C1)NC(=O)C2=CC3=C(C=C2)OCO3)NC(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H24FN3O4/c23-16-8-5-14(6-9-16)12-24-22(28)26-18-4-2-1-3-17(18)25-21(27)15-7-10-19-20(11-15)30-13-29-19/h5-11,17-18H,1-4,12-13H2,(H,25,27)(H2,24,26,28)