N-[3-(2-cyclopentylethanoylamino)-4-fluoranyl-phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-(2-cyclopentylethanoylamino)-4-fluoranyl-phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-[(2-cyclopentylacetyl)amino]-4-fluoro-phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[(2-cyclopentyl-1-oxoethyl)amino]-4-fluorophenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-[(2-cyclopentylacetyl)amino]-4-fluorophenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-[(2-cyclopentylacetyl)amino]-4-fluoro-phenyl]-piperonylamide Formula: C21H21FN2O4 MolecularWeight: 384.400843

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CC(=O)NC2=C(C=CC(=C2)NC(=O)C3=CC4=C(C=C3)OCO4)F

Isomeric SMILES

C1CCC(C1)CC(=O)NC2=C(C=CC(=C2)NC(=O)C3=CC4=C(C=C3)OCO4)F

InChI

InChI=1S/C21H21FN2O4/c22-16-7-6-15(11-17(16)24-20(25)9-13-3-1-2-4-13)23-21(26)14-5-8-18-19(10-14)28-12-27-18/h5-8,10-11,13H,1-4,9,12H2,(H,23,26)(H,24,25)