[4-cyano-1-(2-methylpropyl)pyrrol-2-yl]azanium chloride

Systemtic Name: [4-cyano-1-(2-methylpropyl)pyrrol-2-yl]azanium chloride Openeye Name: (4-cyano-1-isobutyl-pyrrol-2-yl)ammonium chloride CAS Name: [4-cyano-1-(2-methylpropyl)-2-pyrrolyl]ammonium chloride IUPAC Name: [4-cyano-1-(2-methylpropyl)pyrrol-2-yl]azanium chloride Traditional Name: (4-cyano-1-isobutyl-pyrrol-2-yl)ammonium chloride Formula: C9H14ClN3 MolecularWeight: 199.68056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C=C1[NH3+])C#N.[Cl-]

Isomeric SMILES

CC(C)CN1C=C(C=C1[NH3+])C#N.[Cl-]

InChI

InChI=1S/C9H13N3.ClH/c1-7(2)5-12-6-8(4-10)3-9(12)11;/h3,6-7H,5,11H2,1-2H3;1H