4-tert-butyl-N-[3-[1-cyano-2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethylidene]isoindol-1-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[1-cyano-2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethylidene]isoindol-1-yl]benzamide Openeye Name: 4-tert-butyl-N-[3-[1-cyano-2-[(4-methoxyphenyl)methylamino]-2-oxo-ethylidene]isoindol-1-yl]benzamide CAS Name: 4-tert-butyl-N-[3-[1-cyano-2-[(4-methoxyphenyl)methylamino]-2-oxoethylidene]-1-isoindolyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-[1-cyano-2-[(4-methoxyphenyl)methylamino]-2-oxoethylidene]isoindol-1-yl]benzamide Traditional Name: 4-tert-butyl-N-[3-[1-cyano-2-keto-2-(p-anisylamino)ethylidene]isoindol-1-yl]benzamide Formula: C30H28N4O3 MolecularWeight: 492.56832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NC(=C(C#N)C(=O)NCC3=CC=C(C=C3)OC)C4=CC=CC=C42

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NC(=C(C#N)C(=O)NCC3=CC=C(C=C3)OC)C4=CC=CC=C42

InChI

InChI=1S/C30H28N4O3/c1-30(2,3)21-13-11-20(12-14-21)28(35)34-27-24-8-6-5-7-23(24)26(33-27)25(17-31)29(36)32-18-19-9-15-22(37-4)16-10-19/h5-16H,18H2,1-4H3,(H,32,36)(H,33,34,35)