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

Systemtic Name: 6-[[[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[5-(1,3-benzoxazol-2-yl)-2-methyl-anilino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[5-(1,3-benzoxazol-2-yl)-2-methylanilino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[5-(1,3-benzoxazol-2-yl)-2-methylanilino]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[5-(1,3-benzoxazol-2-yl)-2-methyl-anilino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C21H15N3O4 MolecularWeight: 373.3615

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)NC=C4C=C(C=CC4=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)NC=C4C=C(C=CC4=O)[N+](=O)[O-]

InChI

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