N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide

Systemtic Name: N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide Openeye Name: N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]-6-oxo-1-propyl-pyridazine-3-carboxamide CAS Name: N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]-6-oxo-1-propyl-3-pyridazinecarboxamide IUPAC Name: N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]-6-oxo-1-propylpyridazine-3-carboxamide Traditional Name: 6-keto-N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]-1-propyl-pyridazine-3-carboxamide Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)N(C)C(C)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)N(C)[C@H](C)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O4/c1-4-10-20-16(22)9-8-15(18-20)17(23)19(3)12(2)13-6-5-7-14(11-13)21(24)25/h5-9,11-12H,4,10H2,1-3H3/t12-/m1/s1