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

Systemtic Name: 6-[[[5-(5-chloranyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methyl-anilino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylanilino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylanilino]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methyl-anilino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C21H14ClN3O4 MolecularWeight: 407.80656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)Cl)NC=C4C=C(C=CC4=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)Cl)NC=C4C=C(C=CC4=O)[N+](=O)[O-]

InChI

InChI=1S/C21H14ClN3O4/c1-12-2-3-13(21-24-18-10-15(22)4-7-20(18)29-21)9-17(12)23-11-14-8-16(25(27)28)5-6-19(14)26/h2-11,23H,1H3