(2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-(6-methyl-2-nitro-pyridin-3-yl)oxy-propanamide

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-(6-methyl-2-nitro-pyridin-3-yl)oxy-propanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(6-methyl-2-nitro-3-pyridyl)oxy]propanamide CAS Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(6-methyl-2-nitro-3-pyridinyl)oxy]propanamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-(6-methyl-2-nitropyridin-3-yl)oxypropanamide Traditional Name: (2R)-2-[(6-methyl-2-nitro-3-pyridyl)oxy]-N-piperonyl-propionamide Formula: C17H17N3O6 MolecularWeight: 359.33338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)OC(C)C(=O)NCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(C=C1)O[C@H](C)C(=O)NCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O6/c1-10-3-5-14(16(19-10)20(22)23)26-11(2)17(21)18-8-12-4-6-13-15(7-12)25-9-24-13/h3-7,11H,8-9H2,1-2H3,(H,18,21)/t11-/m1/s1