3-[(E)-3-(dibutylamino)prop-1-enyl]-2-(phenylcarbonyl)-1-benzofuran-5-carbonitrile

Systemtic Name: 3-[(E)-3-(dibutylamino)prop-1-enyl]-2-(phenylcarbonyl)-1-benzofuran-5-carbonitrile Openeye Name: 2-benzoyl-3-[(E)-3-(dibutylamino)prop-1-enyl]benzofuran-5-carbonitrile CAS Name: 2-benzoyl-3-[(E)-3-(dibutylamino)prop-1-enyl]-5-benzofurancarbonitrile IUPAC Name: 2-benzoyl-3-[(E)-3-(dibutylamino)prop-1-enyl]-1-benzofuran-5-carbonitrile Traditional Name: 2-benzoyl-3-[(E)-3-(dibutylamino)prop-1-enyl]benzofuran-5-carbonitrile Formula: C27H30N2O2 MolecularWeight: 414.5393

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CC=CC1=C(OC2=C1C=C(C=C2)C#N)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCN(CCCC)C/C=C/C1=C(OC2=C1C=C(C=C2)C#N)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H30N2O2/c1-3-5-16-29(17-6-4-2)18-10-13-23-24-19-21(20-28)14-15-25(24)31-27(23)26(30)22-11-8-7-9-12-22/h7-15,19H,3-6,16-18H2,1-2H3/b13-10+