(4E)-4-[(4-butoxy-3-methoxy-phenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid

Systemtic Name: (4E)-4-[(4-butoxy-3-methoxy-phenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid Openeye Name: (4E)-4-[(4-butoxy-3-methoxy-phenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylic acid CAS Name: (4E)-4-[(4-butoxy-3-methoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid IUPAC Name: (4E)-4-[(4-butoxy-3-methoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid Traditional Name: (4E)-4-(4-butoxy-3-methoxy-benzylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=C2CCCC3=C(C4=CC=CC=C4N=C23)C(=O)O)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C/2\CCCC3=C(C4=CC=CC=C4N=C23)C(=O)O)OC

InChI

InChI=1S/C26H27NO4/c1-3-4-14-31-22-13-12-17(16-23(22)30-2)15-18-8-7-10-20-24(26(28)29)19-9-5-6-11-21(19)27-25(18)20/h5-6,9,11-13,15-16H,3-4,7-8,10,14H2,1-2H3,(H,28,29)/b18-15+