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

Systemtic Name: 6-[[[2-(3,5-dimethylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-methoxy-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[2-(3,5-dimethylphenyl)-1,3-benzoxazol-5-yl]amino]methylene]-2-methoxy-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[2-(3,5-dimethylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-methoxy-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[2-(3,5-dimethylphenyl)-1,3-benzoxazol-5-yl]amino]methylidene]-2-methoxy-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[[2-(3,5-dimethylphenyl)-1,3-benzoxazol-5-yl]amino]methylene]-2-methoxy-4-nitro-cyclohexa-2,4-dien-1-one Formula: C23H19N3O5 MolecularWeight: 417.41406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=NC3=C(O2)C=CC(=C3)NC=C4C=C(C=C(C4=O)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=NC3=C(O2)C=CC(=C3)NC=C4C=C(C=C(C4=O)OC)[N+](=O)[O-])C

InChI

InChI=1S/C23H19N3O5/c1-13-6-14(2)8-15(7-13)23-25-19-10-17(4-5-20(19)31-23)24-12-16-9-18(26(28)29)11-21(30-3)22(16)27/h4-12,24H,1-3H3