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

Systemtic Name: 6-[[[4-(5-tert-butyl-1,3-benzoxazol-2-yl)phenyl]amino]methylidene]-4-chloranyl-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[4-(5-tert-butyl-1,3-benzoxazol-2-yl)anilino]methylene]-4-chloro-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[4-(5-tert-butyl-1,3-benzoxazol-2-yl)anilino]methylidene]-4-chloro-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[4-(5-tert-butyl-1,3-benzoxazol-2-yl)anilino]methylidene]-4-chloro-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[4-(5-tert-butyl-1,3-benzoxazol-2-yl)anilino]methylene]-4-chloro-2-nitro-cyclohexa-2,4-dien-1-one Formula: C24H20ClN3O4 MolecularWeight: 449.8863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC=C4C=C(C=C(C4=O)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC=C4C=C(C=C(C4=O)[N+](=O)[O-])Cl

InChI

InChI=1S/C24H20ClN3O4/c1-24(2,3)16-6-9-21-19(11-16)27-23(32-21)14-4-7-18(8-5-14)26-13-15-10-17(25)12-20(22(15)29)28(30)31/h4-13,26H,1-3H3