4-chloranyl-5-(3-methyl-4-nitro-phenoxy)-2-[(3-methyl-4-nitro-phenoxy)methyl]pyridazin-3-one

Systemtic Name: 4-chloranyl-5-(3-methyl-4-nitro-phenoxy)-2-[(3-methyl-4-nitro-phenoxy)methyl]pyridazin-3-one Openeye Name: 4-chloro-5-(3-methyl-4-nitro-phenoxy)-2-[(3-methyl-4-nitro-phenoxy)methyl]pyridazin-3-one CAS Name: 4-chloro-5-(3-methyl-4-nitrophenoxy)-2-[(3-methyl-4-nitrophenoxy)methyl]-3-pyridazinone IUPAC Name: 4-chloro-5-(3-methyl-4-nitrophenoxy)-2-[(3-methyl-4-nitrophenoxy)methyl]pyridazin-3-one Traditional Name: 4-chloro-5-(3-methyl-4-nitro-phenoxy)-2-[(3-methyl-4-nitro-phenoxy)methyl]pyridazin-3-one Formula: C19H15ClN4O7 MolecularWeight: 446.798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCN2C(=O)C(=C(C=N2)OC3=CC(=C(C=C3)[N+](=O)[O-])C)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCN2C(=O)C(=C(C=N2)OC3=CC(=C(C=C3)[N+](=O)[O-])C)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H15ClN4O7/c1-11-7-13(3-5-15(11)23(26)27)30-10-22-19(25)18(20)17(9-21-22)31-14-4-6-16(24(28)29)12(2)8-14/h3-9H,10H2,1-2H3