3-methyl-4-nitro-N-(2-oxidanylpropyl)benzamide

Systemtic Name: 3-methyl-4-nitro-N-(2-oxidanylpropyl)benzamide Openeye Name: N-(2-hydroxypropyl)-3-methyl-4-nitro-benzamide CAS Name: N-(2-hydroxypropyl)-3-methyl-4-nitrobenzamide IUPAC Name: N-(2-hydroxypropyl)-3-methyl-4-nitrobenzamide Traditional Name: N-(2-hydroxypropyl)-3-methyl-4-nitro-benzamide Formula: C11H14N2O4 MolecularWeight: 238.23986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC(C)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC(C)O)[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O4/c1-7-5-9(3-4-10(7)13(16)17)11(15)12-6-8(2)14/h3-5,8,14H,6H2,1-2H3,(H,12,15)