2-[[(cyanoamino)-quinolin-3-yl-methylidene]amino]ethyl nitrate

Systemtic Name: 2-[[(cyanoamino)-quinolin-3-yl-methylidene]amino]ethyl nitrate Openeye Name: 2-[[(cyanoamino)-(3-quinolyl)methylene]amino]ethyl nitrate CAS Name: nitric acid 2-[[(cyanoamino)-(3-quinolinyl)methylidene]amino]ethyl ester IUPAC Name: 2-[[(cyanoamino)-quinolin-3-ylmethylidene]amino]ethyl nitrate Traditional Name: nitric acid 2-[[(cyanoamino)-(3-quinolyl)methylene]amino]ethyl ester Formula: C13H11N5O3 MolecularWeight: 285.25814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)C(=NCCO[N+](=O)[O-])NC#N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)C(=NCCO[N+](=O)[O-])NC#N

InChI

InChI=1S/C13H11N5O3/c14-9-17-13(15-5-6-21-18(19)20)11-7-10-3-1-2-4-12(10)16-8-11/h1-4,7-8H,5-6H2,(H,15,17)