N-[(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzamide Openeye Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-methyl-propyl]-4-fluoro-benzamide CAS Name: N-[(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide IUPAC Name: N-[(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide Traditional Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-methyl-propyl]-4-fluoro-benzamide Formula: C20H21FN2O4 MolecularWeight: 372.390143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC2=C(C=C1)OCCO2)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC2=C(C=C1)OCCO2)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN2O4/c1-12(2)18(23-19(24)13-3-5-14(21)6-4-13)20(25)22-15-7-8-16-17(11-15)27-10-9-26-16/h3-8,11-12,18H,9-10H2,1-2H3,(H,22,25)(H,23,24)/t18-/m0/s1