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4-(4-nitrophenyl)-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidine-5-carboxylic acid

4-(4-nitrophenyl)-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidine-5-carboxylic acid

Systemtic Name:4-(4-nitrophenyl)-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidine-5-carboxylic acid
Openeye Name:4-(4-nitrophenyl)-2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidine-5-carboxylic acid
CAS Name:4-(4-nitrophenyl)-2-[2-[(5-nitro-2-pyridinyl)amino]ethylamino]-5-pyrimidinecarboxylic acid
IUPAC Name:4-(4-nitrophenyl)-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidine-5-carboxylic acid
Traditional Name:4-(4-nitrophenyl)-2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidine-5-carboxylic acid
Formula: C18H15N7O6
MolecularWeight: 425.355
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=NC=C2C(=O)O)NCCNC3=NC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

C1=CC(=CC=C1C2=NC(=NC=C2C(=O)O)NCCNC3=NC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C18H15N7O6/c26-17(27)14-10-22-18(23-16(14)11-1-3-12(4-2-11)24(28)29)20-8-7-19-15-6-5-13(9-21-15)25(30)31/h1-6,9-10H,7-8H2,(H,19,21)(H,26,27)(H,20,22,23)


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