N-[[5-methyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]-pyridin-4-yl-methyl]-4-nitro-benzamide

Systemtic Name: N-[[5-methyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]-pyridin-4-yl-methyl]-4-nitro-benzamide Openeye Name: N-[(5-methyl-2,4,6-trioxo-hexahydropyrimidin-5-yl)-(4-pyridyl)methyl]-4-nitro-benzamide CAS Name: N-[(5-methyl-2,4,6-trioxo-1,3-diazinan-5-yl)-pyridin-4-ylmethyl]-4-nitrobenzamide IUPAC Name: N-[(5-methyl-2,4,6-trioxo-1,3-diazinan-5-yl)-pyridin-4-ylmethyl]-4-nitrobenzamide Traditional Name: 4-nitro-N-[4-pyridyl-(2,4,6-triketo-5-methyl-hexahydropyrimidin-5-yl)methyl]benzamide Formula: C18H15N5O6 MolecularWeight: 397.3416

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC(=O)NC1=O)C(C2=CC=NC=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1(C(=O)NC(=O)NC1=O)C(C2=CC=NC=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N5O6/c1-18(15(25)21-17(27)22-16(18)26)13(10-6-8-19-9-7-10)20-14(24)11-2-4-12(5-3-11)23(28)29/h2-9,13H,1H3,(H,20,24)(H2,21,22,25,26,27)