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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)NC=C4C=C(C=CC4=O)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)NC=C4C=C(C=CC4=O)[N+](=O)[O-])Cl

InChI

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