[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] (4E)-4-[(4-methoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] (4E)-4-[(4-methoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] (4E)-4-[(4-methoxyphenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4E)-4-[(4-methoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] (4E)-4-[(4-methoxyphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4E)-4-p-anisylidene-2,3-dihydro-1H-acridine-9-carboxylic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C27H25N3O4 MolecularWeight: 455.5051

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C2CCCC3=C(C4=CC=CC=C4N=C23)C(=O)OCC(=O)NCCC#N

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/2\CCCC3=C(C4=CC=CC=C4N=C23)C(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C27H25N3O4/c1-33-20-12-10-18(11-13-20)16-19-6-4-8-22-25(21-7-2-3-9-23(21)30-26(19)22)27(32)34-17-24(31)29-15-5-14-28/h2-3,7,9-13,16H,4-6,8,15,17H2,1H3,(H,29,31)/b19-16+