5-chloranyl-4-[(3-ethoxy-4-methoxy-phenyl)methylamino]-3-nitro-1H-pyridazin-6-one

Systemtic Name: 5-chloranyl-4-[(3-ethoxy-4-methoxy-phenyl)methylamino]-3-nitro-1H-pyridazin-6-one Openeye Name: 5-chloro-4-[(3-ethoxy-4-methoxy-phenyl)methylamino]-3-nitro-1H-pyridazin-6-one CAS Name: 5-chloro-4-[(3-ethoxy-4-methoxyphenyl)methylamino]-3-nitro-1H-pyridazin-6-one IUPAC Name: 5-chloro-4-[(3-ethoxy-4-methoxyphenyl)methylamino]-3-nitro-1H-pyridazin-6-one Traditional Name: 5-chloro-4-[(3-ethoxy-4-methoxy-benzyl)amino]-3-nitro-1H-pyridazin-6-one Formula: C14H15ClN4O5 MolecularWeight: 354.7457

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CNC2=C(C(=O)NN=C2[N+](=O)[O-])Cl)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)CNC2=C(C(=O)NN=C2[N+](=O)[O-])Cl)OC

InChI

InChI=1S/C14H15ClN4O5/c1-3-24-10-6-8(4-5-9(10)23-2)7-16-12-11(15)14(20)18-17-13(12)19(21)22/h4-6H,3,7H2,1-2H3,(H2,16,18,20)