4-bromanyl-2-chloranyl-6-[[[2-oxidanyl-5-[(2S)-pentan-2-yl]phenyl]amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-bromanyl-2-chloranyl-6-[[[2-oxidanyl-5-[(2S)-pentan-2-yl]phenyl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-bromo-2-chloro-6-[[2-hydroxy-5-[(1S)-1-methylbutyl]anilino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-bromo-2-chloro-6-[[2-hydroxy-5-[(2S)-pentan-2-yl]anilino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-bromo-2-chloro-6-[[2-hydroxy-5-[(2S)-pentan-2-yl]anilino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-bromo-2-chloro-6-[[2-hydroxy-5-[(1S)-1-methylbutyl]anilino]methylene]cyclohexa-2,4-dien-1-one Formula: C18H19BrClNO2 MolecularWeight: 396.70596

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=CC(=C(C=C1)O)NC=C2C=C(C=C(C2=O)Cl)Br

Isomeric SMILES

CCC[C@H](C)C1=CC(=C(C=C1)O)NC=C2C=C(C=C(C2=O)Cl)Br

InChI

InChI=1S/C18H19BrClNO2/c1-3-4-11(2)12-5-6-17(22)16(8-12)21-10-13-7-14(19)9-15(20)18(13)23/h5-11,21-22H,3-4H2,1-2H3/t11-/m0/s1