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

Systemtic Name: (6E)-6-[[[3-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[[3-(5-chloro-1,3-benzoxazol-2-yl)anilino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[[3-(5-chloro-1,3-benzoxazol-2-yl)anilino]methylidene]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[[3-(5-chloro-1,3-benzoxazol-2-yl)anilino]methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[[3-(5-chloro-1,3-benzoxazol-2-yl)anilino]methylene]-2-nitro-cyclohexa-2,4-dien-1-one Formula: C20H12ClN3O4 MolecularWeight: 393.77998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC=C2C=CC=C(C2=O)[N+](=O)[O-])C3=NC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1=CC(=CC(=C1)N/C=C/2\C=CC=C(C2=O)[N+](=O)[O-])C3=NC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C20H12ClN3O4/c21-14-7-8-18-16(10-14)23-20(28-18)12-3-1-5-15(9-12)22-11-13-4-2-6-17(19(13)25)24(26)27/h1-11,22H/b13-11+