N-[4-(3,6-dinitropyridazin-4-yl)oxyphenyl]-3-propyl-piperidine-1-carboxamide

Systemtic Name: N-[4-(3,6-dinitropyridazin-4-yl)oxyphenyl]-3-propyl-piperidine-1-carboxamide Openeye Name: N-[4-(3,6-dinitropyridazin-4-yl)oxyphenyl]-3-propyl-piperidine-1-carboxamide CAS Name: N-[4-[(3,6-dinitro-4-pyridazinyl)oxy]phenyl]-3-propyl-1-piperidinecarboxamide IUPAC Name: N-[4-(3,6-dinitropyridazin-4-yl)oxyphenyl]-3-propylpiperidine-1-carboxamide Traditional Name: N-[4-(3,6-dinitropyridazin-4-yl)oxyphenyl]-3-propyl-piperidine-1-carboxamide Formula: C19H22N6O6 MolecularWeight: 430.41458

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCCN(C1)C(=O)NC2=CC=C(C=C2)OC3=CC(=NN=C3[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCC1CCCN(C1)C(=O)NC2=CC=C(C=C2)OC3=CC(=NN=C3[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H22N6O6/c1-2-4-13-5-3-10-23(12-13)19(26)20-14-6-8-15(9-7-14)31-16-11-17(24(27)28)21-22-18(16)25(29)30/h6-9,11,13H,2-5,10,12H2,1H3,(H,20,26)