4-nitro-N-[6-[[(2S)-2-oxidanylpropyl]amino]pyridin-3-yl]benzamide

Systemtic Name: 4-nitro-N-[6-[[(2S)-2-oxidanylpropyl]amino]pyridin-3-yl]benzamide Openeye Name: N-[6-[[(2S)-2-hydroxypropyl]amino]-3-pyridyl]-4-nitro-benzamide CAS Name: N-[6-[[(2S)-2-hydroxypropyl]amino]-3-pyridinyl]-4-nitrobenzamide IUPAC Name: N-[6-[[(2S)-2-hydroxypropyl]amino]pyridin-3-yl]-4-nitrobenzamide Traditional Name: N-[6-[[(2S)-2-hydroxypropyl]amino]-3-pyridyl]-4-nitro-benzamide Formula: C15H16N4O4 MolecularWeight: 316.31194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N4O4/c1-10(20)8-16-14-7-4-12(9-17-14)18-15(21)11-2-5-13(6-3-11)19(22)23/h2-7,9-10,20H,8H2,1H3,(H,16,17)(H,18,21)/t10-/m0/s1