3-(4-butan-2-yloxyphenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-(4-butan-2-yloxyphenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: 2-(6-methyl-1H-benzimidazol-2-yl)-3-(4-sec-butoxyphenyl)prop-2-enenitrile CAS Name: 3-(4-butan-2-yloxyphenyl)-2-(6-methyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: 3-(4-butan-2-yloxyphenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: 2-(6-methyl-1H-benzimidazol-2-yl)-3-(4-sec-butoxyphenyl)acrylonitrile Formula: C21H21N3O MolecularWeight: 331.41094

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)C=C(C#N)C2=NC3=C(N2)C=C(C=C3)C

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)C=C(C#N)C2=NC3=C(N2)C=C(C=C3)C

InChI

InChI=1S/C21H21N3O/c1-4-15(3)25-18-8-6-16(7-9-18)12-17(13-22)21-23-19-10-5-14(2)11-20(19)24-21/h5-12,15H,4H2,1-3H3,(H,23,24)