2-azanyl-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1-phenethyl-pyrrolo[2,3-d]pyridazin-7-one

Systemtic Name: 2-azanyl-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1-phenethyl-pyrrolo[2,3-d]pyridazin-7-one Openeye Name: 2-amino-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1-phenethyl-pyrrolo[2,3-d]pyridazin-7-one CAS Name: 2-amino-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1-phenethyl-7-pyrrolo[2,3-d]pyridazinone IUPAC Name: 2-amino-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1-phenethylpyrrolo[2,3-d]pyridazin-7-one Traditional Name: 2-amino-3-(1,3-benzoxazol-2-yl)-6-methyl-4-nitro-1-phenethyl-pyrrolo[2,3-d]pyridazin-7-one Formula: C22H18N6O4 MolecularWeight: 430.41612

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C(=C(N2CCC3=CC=CC=C3)N)C4=NC5=CC=CC=C5O4)C(=N1)[N+](=O)[O-]

Isomeric SMILES

CN1C(=O)C2=C(C(=C(N2CCC3=CC=CC=C3)N)C4=NC5=CC=CC=C5O4)C(=N1)[N+](=O)[O-]

InChI

InChI=1S/C22H18N6O4/c1-26-22(29)18-16(20(25-26)28(30)31)17(21-24-14-9-5-6-10-15(14)32-21)19(23)27(18)12-11-13-7-3-2-4-8-13/h2-10H,11-12,23H2,1H3