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

Systemtic Name: 6-[[[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[[2-(4-tert-butylphenyl)-1,3-benzoxazol-5-yl]amino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one Formula: C24H21N3O4 MolecularWeight: 415.44124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21N3O4/c1-24(2,3)17-9-7-15(8-10-17)23-26-19-13-18(11-12-21(19)31-23)25-14-16-5-4-6-20(22(16)28)27(29)30/h4-14,25H,1-3H3