1-(1,3-benzodioxol-5-yl)-3-[(3-fluoranyl-4-methyl-phenyl)amino]propan-1-one

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[(3-fluoranyl-4-methyl-phenyl)amino]propan-1-one Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(3-fluoro-4-methyl-anilino)propan-1-one CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(3-fluoro-4-methylanilino)-1-propanone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(3-fluoro-4-methylanilino)propan-1-one Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(3-fluoro-4-methyl-anilino)propan-1-one Formula: C17H16FNO3 MolecularWeight: 301.312243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCCC(=O)C2=CC3=C(C=C2)OCO3)F

Isomeric SMILES

CC1=C(C=C(C=C1)NCCC(=O)C2=CC3=C(C=C2)OCO3)F

InChI

InChI=1S/C17H16FNO3/c1-11-2-4-13(9-14(11)18)19-7-6-15(20)12-3-5-16-17(8-12)22-10-21-16/h2-5,8-9,19H,6-7,10H2,1H3