N-(4-butylphenyl)-2-[1-[(2-chlorophenyl)methyl]-2-oxidanylidene-indol-3-ylidene]-2-cyano-ethanamide

Systemtic Name: N-(4-butylphenyl)-2-[1-[(2-chlorophenyl)methyl]-2-oxidanylidene-indol-3-ylidene]-2-cyano-ethanamide Openeye Name: N-(4-butylphenyl)-2-[1-[(2-chlorophenyl)methyl]-2-oxo-indolin-3-ylidene]-2-cyano-acetamide CAS Name: N-(4-butylphenyl)-2-[1-[(2-chlorophenyl)methyl]-2-oxo-3-indolylidene]-2-cyanoacetamide IUPAC Name: N-(4-butylphenyl)-2-[1-[(2-chlorophenyl)methyl]-2-oxoindol-3-ylidene]-2-cyanoacetamide Traditional Name: N-(4-butylphenyl)-2-[1-(2-chlorobenzyl)-2-keto-indolin-3-ylidene]-2-cyano-acetamide Formula: C28H24ClN3O2 MolecularWeight: 469.96206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C(=C2C3=CC=CC=C3N(C2=O)CC4=CC=CC=C4Cl)C#N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C(=C2C3=CC=CC=C3N(C2=O)CC4=CC=CC=C4Cl)C#N

InChI

InChI=1S/C28H24ClN3O2/c1-2-3-8-19-13-15-21(16-14-19)31-27(33)23(17-30)26-22-10-5-7-12-25(22)32(28(26)34)18-20-9-4-6-11-24(20)29/h4-7,9-16H,2-3,8,18H2,1H3,(H,31,33)