3-azanylbenzenecarbonitrile; 2,3-dimethylcyclopropan-1-one; chloride

Systemtic Name: 3-azanylbenzenecarbonitrile; 2,3-dimethylcyclopropan-1-one; chloride Openeye Name: 3-aminobenzonitrile; 2,3-dimethylcyclopropanone; chloride CAS Name: 3-aminobenzonitrile; 2,3-dimethyl-1-cyclopropanone; chloride IUPAC Name: 3-aminobenzonitrile; 2,3-dimethylcyclopropan-1-one; chloride Traditional Name: 3-aminobenzonitrile; 2,3-dimethylcyclopropanone; chloride Formula: C12H14ClN2O- MolecularWeight: 237.70536

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C1=O)C.C1=CC(=CC(=C1)N)C#N.[Cl-]

Isomeric SMILES

CC1C(C1=O)C.C1=CC(=CC(=C1)N)C#N.[Cl-]

InChI

InChI=1S/C7H6N2.C5H8O.ClH/c8-5-6-2-1-3-7(9)4-6;1-3-4(2)5(3)6;/h1-4H,9H2;3-4H,1-2H3;1H/p-1