4-nitro-2-(2-piperidin-1-ylethoxy)benzenecarbonitrile chloride

Systemtic Name: 4-nitro-2-(2-piperidin-1-ylethoxy)benzenecarbonitrile chloride Openeye Name: 4-nitro-2-[2-(1-piperidyl)ethoxy]benzonitrile chloride CAS Name: 4-nitro-2-[2-(1-piperidinyl)ethoxy]benzonitrile chloride IUPAC Name: 4-nitro-2-(2-piperidin-1-ylethoxy)benzonitrile chloride Traditional Name: 4-nitro-2-(2-piperidinoethoxy)benzonitrile chloride Formula: C14H17ClN3O3- MolecularWeight: 310.75608

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=C(C=CC(=C2)[N+](=O)[O-])C#N.[Cl-]

Isomeric SMILES

C1CCN(CC1)CCOC2=C(C=CC(=C2)[N+](=O)[O-])C#N.[Cl-]

InChI

InChI=1S/C14H17N3O3.ClH/c15-11-12-4-5-13(17(18)19)10-14(12)20-9-8-16-6-2-1-3-7-16;/h4-5,10H,1-3,6-9H2;1H/p-1