6-[[[2-(3-iodanylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[2-(3-iodanylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[[2-(3-iodophenyl)-1,3-benzoxazol-5-yl]amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one Formula: C20H12IN3O4 MolecularWeight: 485.23145

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)C2=NC3=C(O2)C=CC(=C3)NC=C4C=CC=C(C4=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)I)C2=NC3=C(O2)C=CC(=C3)NC=C4C=CC=C(C4=O)[N+](=O)[O-]

InChI

InChI=1S/C20H12IN3O4/c21-14-5-1-3-12(9-14)20-23-16-10-15(7-8-18(16)28-20)22-11-13-4-2-6-17(19(13)25)24(26)27/h1-11,22H