diethoxy-(4-nitrophenoxy)-sulfanylidene-$l^{5}-phosphane; 3-[(2S)-piperidin-2-yl]pyridine; sulfuric acid

Systemtic Name: diethoxy-(4-nitrophenoxy)-sulfanylidene-$l^{5}-phosphane; 3-[(2S)-piperidin-2-yl]pyridine; sulfuric acid Openeye Name: diethoxy-(4-nitrophenoxy)-thioxo-$l^{5}-phosphane; 3-[(2S)-2-piperidyl]pyridine; sulfuric acid CAS Name: diethoxy-(4-nitrophenoxy)-sulfanylidenephosphorane; 3-[(2S)-2-piperidinyl]pyridine; sulfuric acid IUPAC Name: diethoxy-(4-nitrophenoxy)-sulfanylidene-$l^{5}-phosphane; 3-[(2S)-piperidin-2-yl]pyridine; sulfuric acid Traditional Name: diethoxy-(4-nitrophenoxy)-thioxo-phosphorane; 3-[(2S)-2-piperidyl]pyridine; sulfuric acid Formula: C20H30N3O9PS2 MolecularWeight: 551.570661

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(OCC)OC1=CC=C(C=C1)[N+](=O)[O-].C1CCNC(C1)C2=CN=CC=C2.OS(=O)(=O)O

Isomeric SMILES

CCOP(=S)(OCC)OC1=CC=C(C=C1)[N+](=O)[O-].C1CCN[C@@H](C1)C2=CN=CC=C2.OS(=O)(=O)O

InChI

InChI=1S/C10H14N2.C10H14NO5PS.H2O4S/c1-2-7-12-10(5-1)9-4-3-6-11-8-9;1-3-14-17(18,15-4-2)16-10-7-5-9(6-8-10)11(12)13;1-5(2,3)4/h3-4,6,8,10,12H,1-2,5,7H2;5-8H,3-4H2,1-2H3;(H2,1,2,3,4)/t10-;;/m0../s1