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

Systemtic Name: 6-[[[4-(1,3-benzoxazol-2-yl)phenyl]amino]methylidene]-4-methyl-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[4-(1,3-benzoxazol-2-yl)anilino]methylene]-4-methyl-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[4-(1,3-benzoxazol-2-yl)anilino]methylidene]-4-methyl-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[4-(1,3-benzoxazol-2-yl)anilino]methylidene]-4-methyl-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[4-(1,3-benzoxazol-2-yl)anilino]methylene]-4-methyl-2-nitro-cyclohexa-2,4-dien-1-one Formula: C21H15N3O4 MolecularWeight: 373.3615

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3)C(=O)C(=C1)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CNC2=CC=C(C=C2)C3=NC4=CC=CC=C4O3)C(=O)C(=C1)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O4/c1-13-10-15(20(25)18(11-13)24(26)27)12-22-16-8-6-14(7-9-16)21-23-17-4-2-3-5-19(17)28-21/h2-12,22H,1H3