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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(COC2=C(C=CC=C2[N+](=O)[O-])C(=N)Cl)O.Cl

Isomeric SMILES

C1CCN(CC1)CC(COC2=C(C=CC=C2[N+](=O)[O-])C(=N)Cl)O.Cl

InChI

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