(3E)-4-oxidanylidene-3-[[(2-oxidanyl-5-pentan-2-yl-phenyl)amino]methylidene]cyclohexa-1,5-diene-1-carboxylic acid

Systemtic Name: (3E)-4-oxidanylidene-3-[[(2-oxidanyl-5-pentan-2-yl-phenyl)amino]methylidene]cyclohexa-1,5-diene-1-carboxylic acid Openeye Name: (3E)-3-[[2-hydroxy-5-(1-methylbutyl)anilino]methylene]-4-oxo-cyclohexa-1,5-diene-1-carboxylic acid CAS Name: (3E)-3-[(2-hydroxy-5-pentan-2-ylanilino)methylidene]-4-oxo-1-cyclohexa-1,5-dienecarboxylic acid IUPAC Name: (3E)-3-[(2-hydroxy-5-pentan-2-ylanilino)methylidene]-4-oxocyclohexa-1,5-diene-1-carboxylic acid Traditional Name: (3E)-3-[[2-hydroxy-5-(1-methylbutyl)anilino]methylene]-4-keto-cyclohexa-1,5-diene-1-carboxylic acid Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=CC(=C(C=C1)O)NC=C2C=C(C=CC2=O)C(=O)O

Isomeric SMILES

CCCC(C)C1=CC(=C(C=C1)O)N/C=C/2\C=C(C=CC2=O)C(=O)O

InChI

InChI=1S/C19H21NO4/c1-3-4-12(2)13-5-8-18(22)16(10-13)20-11-15-9-14(19(23)24)6-7-17(15)21/h5-12,20,22H,3-4H2,1-2H3,(H,23,24)/b15-11+