N-[(2S)-butan-2-yl]-2,6-dimethoxy-3-nitro-benzamide

Systemtic Name: N-[(2S)-butan-2-yl]-2,6-dimethoxy-3-nitro-benzamide Openeye Name: 2,6-dimethoxy-N-[(1S)-1-methylpropyl]-3-nitro-benzamide CAS Name: N-[(2S)-butan-2-yl]-2,6-dimethoxy-3-nitrobenzamide IUPAC Name: N-[(2S)-butan-2-yl]-2,6-dimethoxy-3-nitrobenzamide Traditional Name: 2,6-dimethoxy-N-[(1S)-1-methylpropyl]-3-nitro-benzamide Formula: C13H18N2O5 MolecularWeight: 282.29242

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1OC)[N+](=O)[O-])OC

Isomeric SMILES

CC[C@H](C)NC(=O)C1=C(C=CC(=C1OC)[N+](=O)[O-])OC

InChI

InChI=1S/C13H18N2O5/c1-5-8(2)14-13(16)11-10(19-3)7-6-9(15(17)18)12(11)20-4/h6-8H,5H2,1-4H3,(H,14,16)/t8-/m0/s1