N-[6-[(2-methyl-1-oxidanyl-propan-2-yl)amino]pyridin-3-yl]-4-nitro-benzamide

Systemtic Name: N-[6-[(2-methyl-1-oxidanyl-propan-2-yl)amino]pyridin-3-yl]-4-nitro-benzamide Openeye Name: N-[6-[(2-hydroxy-1,1-dimethyl-ethyl)amino]-3-pyridyl]-4-nitro-benzamide CAS Name: N-[6-[(1-hydroxy-2-methylpropan-2-yl)amino]-3-pyridinyl]-4-nitrobenzamide IUPAC Name: N-[6-[(1-hydroxy-2-methylpropan-2-yl)amino]pyridin-3-yl]-4-nitrobenzamide Traditional Name: N-[6-[(2-hydroxy-1,1-dimethyl-ethyl)amino]-3-pyridyl]-4-nitro-benzamide Formula: C16H18N4O4 MolecularWeight: 330.33852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)NC1=NC=C(C=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(CO)NC1=NC=C(C=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O4/c1-16(2,10-21)19-14-8-5-12(9-17-14)18-15(22)11-3-6-13(7-4-11)20(23)24/h3-9,21H,10H2,1-2H3,(H,17,19)(H,18,22)