(E)-2-(4-propylphenyl)carbonyl-3-quinoxalin-2-yl-prop-2-enenitrile

Systemtic Name: (E)-2-(4-propylphenyl)carbonyl-3-quinoxalin-2-yl-prop-2-enenitrile Openeye Name: (E)-2-(4-propylbenzoyl)-3-quinoxalin-2-yl-prop-2-enenitrile CAS Name: (E)-2-[oxo-(4-propylphenyl)methyl]-3-(2-quinoxalinyl)-2-propenenitrile IUPAC Name: (E)-2-(4-propylbenzoyl)-3-quinoxalin-2-ylprop-2-enenitrile Traditional Name: (E)-2-(4-propylbenzoyl)-3-quinoxalin-2-yl-acrylonitrile Formula: C21H17N3O MolecularWeight: 327.37918

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)C(=CC2=NC3=CC=CC=C3N=C2)C#N

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)/C(=C/C2=NC3=CC=CC=C3N=C2)/C#N

InChI

InChI=1S/C21H17N3O/c1-2-5-15-8-10-16(11-9-15)21(25)17(13-22)12-18-14-23-19-6-3-4-7-20(19)24-18/h3-4,6-12,14H,2,5H2,1H3/b17-12+