1-butyl-3,5-bis(2,4-dinitrophenyl)pyridin-4-one

Systemtic Name: 1-butyl-3,5-bis(2,4-dinitrophenyl)pyridin-4-one Openeye Name: 1-butyl-3,5-bis(2,4-dinitrophenyl)pyridin-4-one CAS Name: 1-butyl-3,5-bis(2,4-dinitrophenyl)-4-pyridinone IUPAC Name: 1-butyl-3,5-bis(2,4-dinitrophenyl)pyridin-4-one Traditional Name: 1-butyl-3,5-bis(2,4-dinitrophenyl)-4-pyridone Formula: C21H17N5O9 MolecularWeight: 483.38778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C(=O)C(=C1)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCN1C=C(C(=O)C(=C1)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H17N5O9/c1-2-3-8-22-11-17(15-6-4-13(23(28)29)9-19(15)25(32)33)21(27)18(12-22)16-7-5-14(24(30)31)10-20(16)26(34)35/h4-7,9-12H,2-3,8H2,1H3