(2S)-2-chloranyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)propanamide

Systemtic Name: (2S)-2-chloranyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)propanamide Openeye Name: (2S)-N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-propanamide CAS Name: (2S)-N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloropropanamide IUPAC Name: (2S)-N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloropropanamide Traditional Name: (2S)-N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-propionamide Formula: C12H12ClNO4 MolecularWeight: 269.68098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1C(=O)C)OCO2)Cl

Isomeric SMILES

C[C@@H](C(=O)NC1=CC2=C(C=C1C(=O)C)OCO2)Cl

InChI

InChI=1S/C12H12ClNO4/c1-6(13)12(16)14-9-4-11-10(17-5-18-11)3-8(9)7(2)15/h3-4,6H,5H2,1-2H3,(H,14,16)/t6-/m0/s1