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

Systemtic Name: 2-bromanyl-6-[[[3-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]amino]methylidene]-4-methyl-cyclohexa-2,4-dien-1-one Openeye Name: 2-bromo-4-methyl-6-[[3-(5-sec-butyl-1,3-benzoxazol-2-yl)anilino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 2-bromo-6-[[3-(5-butan-2-yl-1,3-benzoxazol-2-yl)anilino]methylidene]-4-methyl-1-cyclohexa-2,4-dienone IUPAC Name: 2-bromo-6-[[3-(5-butan-2-yl-1,3-benzoxazol-2-yl)anilino]methylidene]-4-methylcyclohexa-2,4-dien-1-one Traditional Name: 2-bromo-4-methyl-6-[[3-(5-sec-butyl-1,3-benzoxazol-2-yl)anilino]methylene]cyclohexa-2,4-dien-1-one Formula: C25H23BrN2O2 MolecularWeight: 463.36632

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC=C4C=C(C=C(C4=O)Br)C

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC=C4C=C(C=C(C4=O)Br)C

InChI

InChI=1S/C25H23BrN2O2/c1-4-16(3)17-8-9-23-22(13-17)28-25(30-23)18-6-5-7-20(12-18)27-14-19-10-15(2)11-21(26)24(19)29/h5-14,16,27H,4H2,1-3H3