N-[(2S)-1-[(3,4-dimethoxyphenyl)methyl-methyl-amino]-3-methyl-1-oxidanylidene-butan-2-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[(2S)-1-[(3,4-dimethoxyphenyl)methyl-methyl-amino]-3-methyl-1-oxidanylidene-butan-2-yl]-2-fluoranyl-benzamide Openeye Name: N-[(1S)-1-[(3,4-dimethoxyphenyl)methyl-methyl-carbamoyl]-2-methyl-propyl]-2-fluoro-benzamide CAS Name: N-[(2S)-1-[(3,4-dimethoxyphenyl)methyl-methylamino]-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide IUPAC Name: N-[(2S)-1-[(3,4-dimethoxyphenyl)methyl-methylamino]-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide Traditional Name: 2-fluoro-N-[(1S)-2-methyl-1-[methyl(veratryl)carbamoyl]propyl]benzamide Formula: C22H27FN2O4 MolecularWeight: 402.459183

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N(C)CC1=CC(=C(C=C1)OC)OC)NC(=O)C2=CC=CC=C2F

Isomeric SMILES

CC(C)[C@@H](C(=O)N(C)CC1=CC(=C(C=C1)OC)OC)NC(=O)C2=CC=CC=C2F

InChI

InChI=1S/C22H27FN2O4/c1-14(2)20(24-21(26)16-8-6-7-9-17(16)23)22(27)25(3)13-15-10-11-18(28-4)19(12-15)29-5/h6-12,14,20H,13H2,1-5H3,(H,24,26)/t20-/m0/s1