[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 4-[(4-tert-butylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 4-[(4-tert-butylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 4-[(4-tert-butylphenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: 4-[(4-tert-butylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 4-[(4-tert-butylphenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: 4-(4-tert-butylbenzylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C31H30N2O3 MolecularWeight: 478.5815

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=C2CCCC3=C(C4=CC=CC=C4N=C23)C(=O)OCC(=O)C5=CC=CN5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C=C2CCCC3=C(C4=CC=CC=C4N=C23)C(=O)OCC(=O)C5=CC=CN5

InChI

InChI=1S/C31H30N2O3/c1-31(2,3)22-15-13-20(14-16-22)18-21-8-6-10-24-28(23-9-4-5-11-25(23)33-29(21)24)30(35)36-19-27(34)26-12-7-17-32-26/h4-5,7,9,11-18,32H,6,8,10,19H2,1-3H3