3,5-dinitro-N-[6-[[(2S)-2-oxidanylpropyl]amino]pyridin-3-yl]benzamide

Systemtic Name: 3,5-dinitro-N-[6-[[(2S)-2-oxidanylpropyl]amino]pyridin-3-yl]benzamide Openeye Name: N-[6-[[(2S)-2-hydroxypropyl]amino]-3-pyridyl]-3,5-dinitro-benzamide CAS Name: N-[6-[[(2S)-2-hydroxypropyl]amino]-3-pyridinyl]-3,5-dinitrobenzamide IUPAC Name: N-[6-[[(2S)-2-hydroxypropyl]amino]pyridin-3-yl]-3,5-dinitrobenzamide Traditional Name: N-[6-[[(2S)-2-hydroxypropyl]amino]-3-pyridyl]-3,5-dinitro-benzamide Formula: C15H15N5O6 MolecularWeight: 361.3095

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=NC=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])O

Isomeric SMILES

C[C@@H](CNC1=NC=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])O

InChI

InChI=1S/C15H15N5O6/c1-9(21)7-16-14-3-2-11(8-17-14)18-15(22)10-4-12(19(23)24)6-13(5-10)20(25)26/h2-6,8-9,21H,7H2,1H3,(H,16,17)(H,18,22)/t9-/m0/s1