(E)-2-cyano-4-[1-[(3,4-dichlorophenyl)methyl]indol-3-yl]-N-phenyl-but-2-enamide

Systemtic Name: (E)-2-cyano-4-[1-[(3,4-dichlorophenyl)methyl]indol-3-yl]-N-phenyl-but-2-enamide Openeye Name: (E)-2-cyano-4-[1-[(3,4-dichlorophenyl)methyl]indol-3-yl]-N-phenyl-but-2-enamide CAS Name: (E)-2-cyano-4-[1-[(3,4-dichlorophenyl)methyl]-3-indolyl]-N-phenyl-2-butenamide IUPAC Name: (E)-2-cyano-4-[1-[(3,4-dichlorophenyl)methyl]indol-3-yl]-N-phenylbut-2-enamide Traditional Name: (E)-2-cyano-4-[1-(3,4-dichlorobenzyl)indol-3-yl]-N-phenyl-but-2-enamide Formula: C26H19Cl2N3O MolecularWeight: 460.35456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C(=CCC2=CN(C3=CC=CC=C32)CC4=CC(=C(C=C4)Cl)Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)/C(=C/CC2=CN(C3=CC=CC=C32)CC4=CC(=C(C=C4)Cl)Cl)/C#N

InChI

InChI=1S/C26H19Cl2N3O/c27-23-13-10-18(14-24(23)28)16-31-17-20(22-8-4-5-9-25(22)31)12-11-19(15-29)26(32)30-21-6-2-1-3-7-21/h1-11,13-14,17H,12,16H2,(H,30,32)/b19-11+