N-[(3Z)-3-[1-cyano-2-oxidanylidene-2-(1-phenylethylamino)ethylidene]isoindol-1-yl]-4-methoxy-benzamide

Systemtic Name: N-[(3Z)-3-[1-cyano-2-oxidanylidene-2-(1-phenylethylamino)ethylidene]isoindol-1-yl]-4-methoxy-benzamide Openeye Name: N-[(3Z)-3-[1-cyano-2-oxo-2-(1-phenylethylamino)ethylidene]isoindol-1-yl]-4-methoxy-benzamide CAS Name: N-[(3Z)-3-[1-cyano-2-oxo-2-(1-phenylethylamino)ethylidene]-1-isoindolyl]-4-methoxybenzamide IUPAC Name: N-[(3Z)-3-[1-cyano-2-oxo-2-(1-phenylethylamino)ethylidene]isoindol-1-yl]-4-methoxybenzamide Traditional Name: N-[(3Z)-3-[1-cyano-2-keto-2-(1-phenylethylamino)ethylidene]isoindol-1-yl]-4-methoxy-benzamide Formula: C27H22N4O3 MolecularWeight: 450.48858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(=C2C3=CC=CC=C3C(=N2)NC(=O)C4=CC=C(C=C4)OC)C#N

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)/C(=C\2/C3=CC=CC=C3C(=N2)NC(=O)C4=CC=C(C=C4)OC)/C#N

InChI

InChI=1S/C27H22N4O3/c1-17(18-8-4-3-5-9-18)29-27(33)23(16-28)24-21-10-6-7-11-22(21)25(30-24)31-26(32)19-12-14-20(34-2)15-13-19/h3-15,17H,1-2H3,(H,29,33)(H,30,31,32)/b24-23-