N-[2-[3-(4-fluorophenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[2-[3-(4-fluorophenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-3-methyl-4-nitro-benzamide Openeye Name: N-[2-[3-(4-fluorophenyl)-6-oxo-pyridazin-1-yl]ethyl]-3-methyl-4-nitro-benzamide CAS Name: N-[2-[3-(4-fluorophenyl)-6-oxo-1-pyridazinyl]ethyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[2-[3-(4-fluorophenyl)-6-oxopyridazin-1-yl]ethyl]-3-methyl-4-nitrobenzamide Traditional Name: N-[2-[3-(4-fluorophenyl)-6-keto-pyridazin-1-yl]ethyl]-3-methyl-4-nitro-benzamide Formula: C20H17FN4O4 MolecularWeight: 396.371783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C20H17FN4O4/c1-13-12-15(4-8-18(13)25(28)29)20(27)22-10-11-24-19(26)9-7-17(23-24)14-2-5-16(21)6-3-14/h2-9,12H,10-11H2,1H3,(H,22,27)