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

Systemtic Name: 6-[[[4-chloranyl-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]amino]methylidene]-4-methyl-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)anilino]methylene]-4-methyl-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)anilino]methylidene]-4-methyl-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)anilino]methylidene]-4-methyl-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[4-chloro-3-(5-methyl-1,3-benzoxazol-2-yl)anilino]methylene]-4-methyl-2-nitro-cyclohexa-2,4-dien-1-one Formula: C22H16ClN3O4 MolecularWeight: 421.83314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=N2)C3=C(C=CC(=C3)NC=C4C=C(C=C(C4=O)[N+](=O)[O-])C)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=N2)C3=C(C=CC(=C3)NC=C4C=C(C=C(C4=O)[N+](=O)[O-])C)Cl

InChI

InChI=1S/C22H16ClN3O4/c1-12-3-6-20-18(8-12)25-22(30-20)16-10-15(4-5-17(16)23)24-11-14-7-13(2)9-19(21(14)27)26(28)29/h3-11,24H,1-2H3