4-nitro-2-(piperidin-1-ylmethyl)-2H-quinolin-1-ium 1-oxide

Systemtic Name: 4-nitro-2-(piperidin-1-ylmethyl)-2H-quinolin-1-ium 1-oxide Openeye Name: 4-nitro-2-(1-piperidylmethyl)-2H-quinolin-1-ium 1-oxide CAS Name: 4-nitro-2-(1-piperidinylmethyl)-2H-quinolin-1-ium 1-oxide IUPAC Name: 4-nitro-2-(piperidin-1-ylmethyl)-2H-quinolin-1-ium 1-oxide Traditional Name: 4-nitro-2-(piperidinomethyl)-2H-quinolin-1-ium 1-oxide Formula: C15H18N3O3+ MolecularWeight: 288.32172

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2C=C(C3=CC=CC=C3[N+]2=O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CC2C=C(C3=CC=CC=C3[N+]2=O)[N+](=O)[O-]

InChI

InChI=1S/C15H18N3O3/c19-17-12(11-16-8-4-1-5-9-16)10-15(18(20)21)13-6-2-3-7-14(13)17/h2-3,6-7,10,12H,1,4-5,8-9,11H2/q+1