butanedioic acid; (2Z)-2-(nitromethylidene)-1-(pyridin-4-ylmethyl)-1,3-diazinane

Systemtic Name: butanedioic acid; (2Z)-2-(nitromethylidene)-1-(pyridin-4-ylmethyl)-1,3-diazinane Openeye Name: (2Z)-2-(nitromethylene)-1-(4-pyridylmethyl)hexahydropyrimidine; succinic acid CAS Name: butanedioic acid; (2Z)-2-(nitromethylidene)-1-(pyridin-4-ylmethyl)-1,3-diazinane IUPAC Name: butanedioic acid; (2Z)-2-(nitromethylidene)-1-(pyridin-4-ylmethyl)-1,3-diazinane Traditional Name: (2Z)-2-(nitromethylene)-1-(4-pyridylmethyl)hexahydropyrimidine; succinic acid Formula: C15H20N4O6 MolecularWeight: 352.3425

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=C[N+](=O)[O-])N(C1)CC2=CC=NC=C2.C(CC(=O)O)C(=O)O

Isomeric SMILES

C1CN/C(=C/[N+](=O)[O-])/N(C1)CC2=CC=NC=C2.C(CC(=O)O)C(=O)O

InChI

InChI=1S/C11H14N4O2.C4H6O4/c16-15(17)9-11-13-4-1-7-14(11)8-10-2-5-12-6-3-10;5-3(6)1-2-4(7)8/h2-3,5-6,9,13H,1,4,7-8H2;1-2H2,(H,5,6)(H,7,8)/b11-9-;