(2R)-N-(1,3-benzodioxol-5-yl)-2-(4-methyl-2-nitro-phenoxy)propanamide

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-methyl-2-nitro-phenoxy)propanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-methyl-2-nitro-phenoxy)propanamide CAS Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-methyl-2-nitrophenoxy)propanamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-methyl-2-nitrophenoxy)propanamide Traditional Name: (2R)-N-(1,3-benzodioxol-5-yl)-2-(4-methyl-2-nitro-phenoxy)propionamide Formula: C17H16N2O6 MolecularWeight: 344.31874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(C)C(=O)NC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)O[C@H](C)C(=O)NC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O6/c1-10-3-5-14(13(7-10)19(21)22)25-11(2)17(20)18-12-4-6-15-16(8-12)24-9-23-15/h3-8,11H,9H2,1-2H3,(H,18,20)/t11-/m1/s1