8-(3-nitrophenyl)-6-(pyridin-4-ylmethyl)pyrido[2,3-d]pyridazin-5-one hydrochloride

Systemtic Name: 8-(3-nitrophenyl)-6-(pyridin-4-ylmethyl)pyrido[2,3-d]pyridazin-5-one hydrochloride Openeye Name: 8-(3-nitrophenyl)-6-(4-pyridylmethyl)pyrido[2,3-d]pyridazin-5-one hydrochloride CAS Name: 8-(3-nitrophenyl)-6-(pyridin-4-ylmethyl)-5-pyrido[2,3-d]pyridazinone hydrochloride IUPAC Name: 8-(3-nitrophenyl)-6-(pyridin-4-ylmethyl)pyrido[2,3-d]pyridazin-5-one hydrochloride Traditional Name: 8-(3-nitrophenyl)-6-(4-pyridylmethyl)pyrido[2,3-d]pyridazin-5-one hydrochloride Formula: C19H14ClN5O3 MolecularWeight: 395.79916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NN(C(=O)C3=C2N=CC=C3)CC4=CC=NC=C4.Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NN(C(=O)C3=C2N=CC=C3)CC4=CC=NC=C4.Cl

InChI

InChI=1S/C19H13N5O3.ClH/c25-19-16-5-2-8-21-18(16)17(14-3-1-4-15(11-14)24(26)27)22-23(19)12-13-6-9-20-10-7-13;/h1-11H,12H2;1H