(E)-2-(1H-benzimidazol-2-yl)-3-[(4-butoxyphenyl)amino]prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-[(4-butoxyphenyl)amino]prop-2-enenitrile Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-(4-butoxyanilino)prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-(4-butoxyanilino)-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-(4-butoxyanilino)prop-2-enenitrile Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-(4-butoxyanilino)acrylonitrile Formula: C20H20N4O MolecularWeight: 332.399

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC=C(C#N)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N/C=C(\C#N)/C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C20H20N4O/c1-2-3-12-25-17-10-8-16(9-11-17)22-14-15(13-21)20-23-18-6-4-5-7-19(18)24-20/h4-11,14,22H,2-3,12H2,1H3,(H,23,24)/b15-14+