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

Systemtic Name: 5-chloranyl-4-[(4-methoxy-3-propoxy-phenyl)methylamino]-3-nitro-1H-pyridazin-6-one Openeye Name: 5-chloro-4-[(4-methoxy-3-propoxy-phenyl)methylamino]-3-nitro-1H-pyridazin-6-one CAS Name: 5-chloro-4-[(4-methoxy-3-propoxyphenyl)methylamino]-3-nitro-1H-pyridazin-6-one IUPAC Name: 5-chloro-4-[(4-methoxy-3-propoxyphenyl)methylamino]-3-nitro-1H-pyridazin-6-one Traditional Name: 5-chloro-4-[(4-methoxy-3-propoxy-benzyl)amino]-3-nitro-1H-pyridazin-6-one Formula: C15H17ClN4O5 MolecularWeight: 368.77228

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)CNC2=C(C(=O)NN=C2[N+](=O)[O-])Cl)OC

Isomeric SMILES

CCCOC1=C(C=CC(=C1)CNC2=C(C(=O)NN=C2[N+](=O)[O-])Cl)OC

InChI

InChI=1S/C15H17ClN4O5/c1-3-6-25-11-7-9(4-5-10(11)24-2)8-17-13-12(16)15(21)19-18-14(13)20(22)23/h4-5,7H,3,6,8H2,1-2H3,(H2,17,19,21)