N-[(2S)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-2-bromanyl-benzamide

Systemtic Name: N-[(2S)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-2-bromanyl-benzamide Openeye Name: N-[(1S)-1-(1,3-benzodioxol-5-ylcarbamoyl)-2-methyl-propyl]-2-bromo-benzamide CAS Name: N-[(2S)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxobutan-2-yl]-2-bromobenzamide IUPAC Name: N-[(2S)-1-(1,3-benzodioxol-5-ylamino)-3-methyl-1-oxobutan-2-yl]-2-bromobenzamide Traditional Name: N-[(1S)-1-(1,3-benzodioxol-5-ylcarbamoyl)-2-methyl-propyl]-2-bromo-benzamide Formula: C19H19BrN2O4 MolecularWeight: 419.26916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C19H19BrN2O4/c1-11(2)17(22-18(23)13-5-3-4-6-14(13)20)19(24)21-12-7-8-15-16(9-12)26-10-25-15/h3-9,11,17H,10H2,1-2H3,(H,21,24)(H,22,23)/t17-/m0/s1