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

Systemtic Name: N-[4-fluoranyl-3-(4-methylpentanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-fluoro-3-(4-methylpentanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-fluoro-3-[(4-methyl-1-oxopentyl)amino]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-fluoro-3-(4-methylpentanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-fluoro-3-(4-methylpentanoylamino)phenyl]-piperonylamide Formula: C20H21FN2O4 MolecularWeight: 372.390143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)NC1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)F

Isomeric SMILES

CC(C)CCC(=O)NC1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)F

InChI

InChI=1S/C20H21FN2O4/c1-12(2)3-8-19(24)23-16-10-14(5-6-15(16)21)22-20(25)13-4-7-17-18(9-13)27-11-26-17/h4-7,9-10,12H,3,8,11H2,1-2H3,(H,22,25)(H,23,24)