[3,4-bis(oxidanylidene)-2-pyridin-3-yl-cyclobuten-1-yl]-dimethyl-propyl-azanium hydrochloride

Systemtic Name: [3,4-bis(oxidanylidene)-2-pyridin-3-yl-cyclobuten-1-yl]-dimethyl-propyl-azanium hydrochloride Openeye Name: [3,4-dioxo-2-(3-pyridyl)cyclobuten-1-yl]-dimethyl-propyl-ammonium hydrochloride CAS Name: [3,4-dioxo-2-(3-pyridinyl)-1-cyclobutenyl]-dimethyl-propylammonium hydrochloride IUPAC Name: (3,4-dioxo-2-pyridin-3-ylcyclobuten-1-yl)-dimethyl-propylazanium hydrochloride Traditional Name: [3,4-diketo-2-(3-pyridyl)cyclobuten-1-yl]-dimethyl-propyl-ammonium hydrochloride Formula: C14H18ClN2O2+ MolecularWeight: 281.75792

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C)(C)C1=C(C(=O)C1=O)C2=CN=CC=C2.Cl

Isomeric SMILES

CCC[N+](C)(C)C1=C(C(=O)C1=O)C2=CN=CC=C2.Cl

InChI

InChI=1S/C14H17N2O2.ClH/c1-4-8-16(2,3)12-11(13(17)14(12)18)10-6-5-7-15-9-10;/h5-7,9H,4,8H2,1-3H3;1H/q+1;