(Z)-3-[4-(diethylamino)-3-nitro-phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: (Z)-3-[4-(diethylamino)-3-nitro-phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: (Z)-3-[4-(diethylamino)-3-nitro-phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: (Z)-3-[4-(diethylamino)-3-nitrophenyl]-2-(6-methyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: (Z)-3-[4-(diethylamino)-3-nitrophenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: (Z)-3-[4-(diethylamino)-3-nitro-phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)acrylonitrile Formula: C21H21N5O2 MolecularWeight: 375.42374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)C=C(C#N)C2=NC3=C(N2)C=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)/C=C(/C#N)\C2=NC3=C(N2)C=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O2/c1-4-25(5-2)19-9-7-15(12-20(19)26(27)28)11-16(13-22)21-23-17-8-6-14(3)10-18(17)24-21/h6-12H,4-5H2,1-3H3,(H,23,24)/b16-11-