(1Z)-3-nitro-N-(2-oxidanyl-3-piperidin-1-yl-propoxy)benzenecarboximidoyl chloride hydrochloride

Systemtic Name: (1Z)-3-nitro-N-(2-oxidanyl-3-piperidin-1-yl-propoxy)benzenecarboximidoyl chloride hydrochloride Openeye Name: (1Z)-N-[2-hydroxy-3-(1-piperidyl)propoxy]-3-nitro-benzimidoyl chloride hydrochloride CAS Name: (1Z)-N-[2-hydroxy-3-(1-piperidinyl)propoxy]-3-nitrobenzenecarboximidoyl chloride hydrochloride IUPAC Name: (1Z)-N-(2-hydroxy-3-piperidin-1-ylpropoxy)-3-nitrobenzenecarboximidoyl chloride hydrochloride Traditional Name: (1Z)-N-(2-hydroxy-3-piperidino-propoxy)-3-nitro-benzimidoyl chloride hydrochloride Formula: C15H21Cl2N3O4 MolecularWeight: 378.25094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(CON=C(C2=CC(=CC=C2)[N+](=O)[O-])Cl)O.Cl

Isomeric SMILES

C1CCN(CC1)CC(CO/N=C(/C2=CC(=CC=C2)[N+](=O)[O-])\Cl)O.Cl

InChI

InChI=1S/C15H20ClN3O4.ClH/c16-15(12-5-4-6-13(9-12)19(21)22)17-23-11-14(20)10-18-7-2-1-3-8-18;/h4-6,9,14,20H,1-3,7-8,10-11H2;1H/b17-15-;