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

Systemtic Name: N-[2-[3-(4-chlorophenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[2-[3-(4-chlorophenyl)-6-oxo-pyridazin-1-yl]ethyl]-2-methyl-3-nitro-benzamide CAS Name: N-[2-[3-(4-chlorophenyl)-6-oxo-1-pyridazinyl]ethyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[2-[3-(4-chlorophenyl)-6-oxopyridazin-1-yl]ethyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[2-[3-(4-chlorophenyl)-6-keto-pyridazin-1-yl]ethyl]-2-methyl-3-nitro-benzamide Formula: C20H17ClN4O4 MolecularWeight: 412.82638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17ClN4O4/c1-13-16(3-2-4-18(13)25(28)29)20(27)22-11-12-24-19(26)10-9-17(23-24)14-5-7-15(21)8-6-14/h2-10H,11-12H2,1H3,(H,22,27)